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1 to 50 of 62 Products/Chemicals (Click for related suppliers)  Page: [1] 2 >> Next 50 Results
• Allylestrenol
IUPAC Name: (8R,9S,10R,13S,14S,17R)-13-methyl-17-prop-2-enyl-2,3,6,7,8,9,10,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-ol | CAS Registry Number: 432-60-0
Synonyms: allylestrenol, Gestanin, Gestanol, Gestanon, Gestanyn, Orageston, Organon, Turinal, Allyloestrenol, Gestormone, Perselin, Allyloestrenolum, Estrenol, allyl-, Gestanon-r, Perselin (TN), 17alpha-Allylestrenol, Allilestrenolo [DCIT], 17.alpha.-Allylestrenol, Allylestrenol (JAN/INN), Allylestrenol [INN:JAN]

Molecular Formula: C21H32OMolecular Weight: 300.478180 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: ATXHVCQZZJYMCF-XUDSTZEESA-N

• C-(3,4-Dimethoxy-Bicyclo[4.2.0]Octa-1(6),2,4-Trien-7-Yl)-Methylamine
IUPAC Name: (3,4-dimethoxy-7-bicyclo[4.2.0]octa-1,3,5-trienyl)methanamine | CAS Registry Number: 73344-75-9
Synonyms: (3,4-Dimethoxybicyclo[4.2.0]octa-1,3,5-trien-7-yl)methanamine, 35202-55-2, NSC154409, NSC268229, (3,4-Dimethoxybicyclo(4.2.0)octa-1,3,5-trien-7-yl)methanamine, NSC 154409, AGN-PC-00AHMW, SureCN383341, AC1L9NR3, SureCN7911834, ride, (.+-.)-, CTK1C3746, MolPort-005-943-406, AKOS006331068, AG-F-21343, NSC 268229, AK120376, KB-207006, (3,4-dimethoxy-7-bicyclo[4.2.0]octa-1,3,5-trienyl)methanamine, (3,4-Dimethoxybicyclo[4.2.0]octa-1,3,5-trien-7-yl)methanamine; (3,4-Dimethoxybicyclo[4.2.0]octa-1,3,5-trien-7-yl)methylamine; {Bicyclo[4.2.0]octa-1,3,5-triene-7-methanamine,} 3,4-dimethoxy-, hydrochlo

Molecular Formula: C11H15NO2Molecular Weight: 193.242300 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: JDZSBHBIJDIACW-UHFFFAOYSA-N

• Chlorocyclohexane
IUPAC Name: chlorocyclohexane | CAS Registry Number: 542-18-7
Synonyms: CHLOROCYCLOHEXANE, Cyclohexyl chloride, Cyclohexane, chloro-, Monochlorocyclohexane, Chlorcyclohexan, Chlorzyklohexan, chlor-cyclohexane, HSDB 2801, C105058_ALDRICH, NSC 8434, 24160_FLUKA, CHEBI:39156, EINECS 208-806-6, NSC8434, CID10952, BRN 1900796, AI3-23841, LS-56754, 4-05-00-00048 (Beilstein Handbook Reference), InChI=1/C6H11Cl/c7-6-4-2-1-3-5-6/h6H,1-5H

Molecular Formula: C6H11ClMolecular Weight: 118.604540 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: UNFUYWDGSFDHCW-UHFFFAOYSA-N

• Cilomelast
IUPAC Name: 4-cyano-4-(3-cyclopentyloxy-4-methoxyphenyl)cyclohexane-1-carboxylic acid | CAS Registry Number: 153259-65-5
Synonyms: Cilomilast, Ariflo, 1xlx, 1xom, Ariflo (TN), Cilomilast [USAN:INN], Cilomilast (JAN/USAN/INN), PDSP1_001287, PDSP2_001271, SB207499, DB03849, SB 207499, NCGC00167520-01, LS-56637, SB-207499, D01704, cis-4-Cyano-4-(3-cyclopentyloxy-4-methoxyphenyl)cyclohexanecarboxylic acid, cis-4-(3-(Cyclopentyloxy)-4-methoxyphenyl)-4-cyanocyclohexane-1-carboxylic acid, CIS-4-CYANO-4-[3-(CYCLOPENTYLOXY)-4-METHOXYPHENYL]CYCLOHEXANECARBOXYLIC ACID, Cyclohexanecarboxylic acid, 4-cyano-4-(3-(cyclopentyloxy)-4-methoxyphenyl)-, cis-

Molecular Formula: C20H25NO4Molecular Weight: 343.416800 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: CFBUZOUXXHZCFB-UHFFFAOYSA-N

• Cisatracurium Besilate (Ninbex)
IUPAC Name: benzenesulfonate; benzenesulfonate; 5-[3-[(1R,2R)-1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-2-yl]propanoyloxy]pentyl 3-[(1R,2R)-1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-2-yl]propanoate | CAS Registry Number: 96946-42-8
Synonyms: Nimbex, Cisatracurium, Cisatracurium besylate, Nimbium, Cisatracurium besilate, Benzenesulfonate, Nimbex Forte, Nimbex (TN), Cisatracurium besilate (INN), Cisatracurium besylate (USAN), NIMBEX PRESERVATIVE FREE, Cisatracurium besylate [USAN:BAN], 51W89, Atracurium besylate 1R-cis,1R'-cis form, C53H72N2O12.2C6H5O3S, DB00565, (1R-cis,1'R-cis)-Atracurium besylate, NCGC00017127-01, CAS-64228-81-5, LS-178337

Molecular Formula: C65H82N2O18S2Molecular Weight: 1243.479180 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 18

InChIKey: XXZSQOVSEBAPGS-DONVQRBFSA-L

• Cyclopentyl Chloride
IUPAC Name: chlorocyclopentane | CAS Registry Number: 930-28-9
Synonyms: Chlorocyclopentane, Cyclopentane, chloro-, Cyclopentyl chloride, sFpHADILimUP@, 155136_ALDRICH, 24190_FLUKA, NSC16930, EINECS 213-212-5, AI3-23449, InChI=1/C5H9Cl/c6-5-3-1-2-4-5/h5H,1-4H

Molecular Formula: C5H9ClMolecular Weight: 104.577960 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: NDTCXABJQNJPCF-UHFFFAOYSA-N

• Eplerenone
Synonyms: Epoxymexrenone, Inspra, Selara, Inspra (TN), Eplerenone (JAN/USAN/INN), CHEBI:31547, CGP-30083, NCGC00159559-01, NCGC00159559-02, SC-66110, TL8000270, C12512, D01115, 7alpha-methoxycarbonyl-3-oxo-9,11alpha-epoxy-17alpha-pregn-4-ene-21,17-carbolactone

Molecular Formula: C24H30O6Molecular Weight: 414.491400 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 6

InChIKey: JUKPWJGBANNWMW-VWBFHTRKSA-N

• Ethanone, 1-cyclopropyl-2-(2-fluorophenyl)-
IUPAC Name: 1-cyclopropyl-2-(2-fluorophenyl)ethanone | CAS Registry Number: 150322-73-9
Synonyms: Cyclopropyl 2-fluorobenzyl ketone, 1-cyclopropyl-2-(2-fluorophenyl)ethanone, Cyclopropyl2-fluorobenzylketone, 1-Cyclopropyl-2-(2-fluoro-phenyl)-ethanone, AG-D-96933, Ethanone,1-cyclopropyl-2-(2-fluorophenyl)-, prasugrl I, PubChem19831, AGN-PC-00OREF, ACMC-209d4d, SureCN243780, KSC526M0D, ETH030, Cyclopropyl 2-fluorobenzylketone, CTK4C6601, MolPort-003-986-456, Cyclopropyl-2-fluoro benzyl ketone, ACT06895, ANW-21275, FC1323

Molecular Formula: C11H11FOMolecular Weight: 178.202843 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: DWBGTJUQWKWYGB-UHFFFAOYSA-N

• Febuxostat
IUPAC Name: 2-[3-cyano-4-(2-methylpropoxy)phenyl]-4-methyl-1,3-thiazole-5-carboxylic acid | CAS Registry Number: 144060-53-7
Synonyms: Adenuric, Uloric, Febuxostat [USAN], Tei-6720, Tei 6720, TMX 67, TMX-67, Febuxostat (JAN/USAN/INN), C16H16N2O3S, CID134018, LS-173202, D01206, 2-(3-Cyano-4-isobutoxyphenyl)-4-methyl-5-thiazolecarboxylic acid, 2-(3-Cyano-4-(2-methylpropoxy)phenyl)-4-methylthiazole-5-carboxylic acid, 5-Thiazolecarboxylic acid, 2-(3-cyano-4-(2-methylpropoxy)phenyl)-4-methyl-, 2-(3-CYANO-4-ISOBUTOXY-PHENYL)-4-METHYL-5-THIAZOLE-CARBOXYLIC ACID, TEI

Molecular Formula: C16H16N2O3SMolecular Weight: 316.374840 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: BQSJTQLCZDPROO-UHFFFAOYSA-N

• Formamide, N-[2-Hydroxy-5-[(1R)-1-Hydroxy-2-[[(1R)-2-(4-Methoxyphenyl)-1-Methylethyl]amino]ethyl]phenyl]-, (2R,3R)-
IUPAC Name: N-[2-hydroxy-5-[(1R)-1-hydroxy-2-[[(2R)-1-(4-methoxyphenyl)propan-2-yl]amino]ethyl]phenyl]formamide | CAS Registry Number: 67346-49-0
Synonyms: formoterol, Arformoterol, Symbicort, Foradil, (R,R)-Formoterol, (-)-Formoterol, Arformoterol (INN), UNII-F91H02EBWT, Bio-0043, CHEBI:408174, CID3083544, DB01274, D07463, 208102-40-3, 289657-27-8, 299964-45-7, 73573-87-2, Formamide, N-(2-hydroxy-5-((1R)-1-hydroxy-2-(((1R)-2-(4-methoxyphenyl)-1-methylethyl)amino)ethyl)phenyl)-, Formamide, N-(2-hydroxy-5-(1-hydroxy-2-((2-(4-methoxyphenyl)-1-methylethyl)amino)ethyl)phenyl)-, (R-(R*,R*))-, N-(2-Hydroxy-5-{1-hydroxy-2-[2-(4-methoxy-phenyl)-1-methyl-ethylamino]-ethyl}-phenyl)-formamide

Molecular Formula: C19H24N2O4Molecular Weight: 344.404860 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 5

InChIKey: BPZSYCZIITTYBL-YJYMSZOUSA-N

• Isobutyl chloride
IUPAC Name: 1-chloro-2-methylpropane | CAS Registry Number: 513-36-0
Synonyms: ISOBUTYL CHLORIDE, 1-Chloro-2-methylpropane, sJPHADIKUP@, Propane, 1-chloro-2-methyl-, 2-Chloro-2-methylpropane, 178004_ALDRICH, EINECS 208-157-9, InChI=1/C4H9Cl/c1-4(2)3-5/h4H,3H2,1-2H

Molecular Formula: C4H9ClMolecular Weight: 92.567260 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: QTBFPMKWQKYFLR-UHFFFAOYSA-N

• Isopropyl chloride
IUPAC Name: 2-chloropropane | CAS Registry Number: 75-29-6
Synonyms: Narcosop, Isoprid, Propane, 2-chloro-, Isopropylchloride, 2-CHLOROPROPANE, 2-Propyl chloride, sec-Propyl chloride, Chlorodimethylmethane, 2-CHLORO-PROPANE, CCRIS 874, C68563_ALDRICH, HSDB 5204, 240613_ALDRICH, 02489_FLUKA, EINECS 200-858-8, UN2356, BRN 1730782, AI3-18025, LS-119656, 2-Chloropropane [UN2356] [Flammable liquid]

Molecular Formula: C3H7ClMolecular Weight: 78.540680 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: ULYZAYCEDJDHCC-UHFFFAOYSA-N

• Ivabradine
IUPAC Name: 3-[3-[[(8S)-3,4-dimethoxy-8-bicyclo[4.2.0]octa-1,3,5-trienyl]methyl-methylamino]propyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one | CAS Registry Number: 155974-00-8
Synonyms: Procoralan, Ivabradine (INN), Ivabradine [INN], UNII-3H48L0LPZQ, CHEBI:548872, MolPort-003-986-484, C27H36N2O5, CID132999, NCGC00181343-01, LS-28023, TL8001175, S 16257, S-16257, D07165, S 16257-2, S 16260-2, S-16257-2, S-16260-2, (-)-S 16260, (S)-3-(3-(((3,4-Dimethoxybicyclo(4.2.0)octa-1,3,5-trien-7-yl)methyl)methylamino)propyl)-1,3,4,5-tetrahydro-7,8-dimethoxy-2H-3-benzazepin-2-one

Molecular Formula: C27H36N2O5Molecular Weight: 468.585140 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 6

InChIKey: ACRHBAYQBXXRTO-OAQYLSRUSA-N

• Ivabradine Hydrochloride
IUPAC Name: 3-[3-[[(8S)-3,4-dimethoxy-8-bicyclo[4.2.0]octa-1,3,5-trienyl]methyl-methylamino]propyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one hydrochloride | CAS Registry Number: 148849-67-6
Synonyms: Procoralan, Corlentor, Ivabradine hydrochloride, LS-28024, S-16257, S-16257-2, S-16260-2, (7,8-Dimethoxy 3-(3-(((1S)-(4,5-dimethoxybenzocyclobutan-1-yl)methyl)methylamino)propyl)-1,3,4,5-tetrahydro-2H-benzazepin-2-one hydrochloride, 2H-3-Benzazepin-2-one, 3-(3-((((7S)-3,4-dimethoxybicyclo(4.2.0)octa-1,3,5-trien-7-yl)methyl)methylamino)propyl)-1,3,4,5-tetrahydro-7,8-dimethoxy-, monohydrochloride, 2H-3-Benzazepin-2-one, 3-(3-(((3,4-dimethoxybicyclo(4.2.0)octa-1,3,5-trien-7-yl)methyl)methylamino)propyl)-1,3,4,5-tetrahydro-7,8-dimethoxy-, monohydrochloride, (S)-

Molecular Formula: C27H37ClN2O5Molecular Weight: 505.046080 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 6

InChIKey: HLUKNZUABFFNQS-ZMBIFBSDSA-N

• Lauryl Chloride
IUPAC Name: 1-chlorododecane | CAS Registry Number: 112-52-7
Synonyms: Lauryl chloride, n-Dodecyl chloride, Dodecyl chloride, Dodecane, 1-chloro-, 1-CHLORODODECANE, DODECANE,1-CHLORO, CCRIS 5810, 24498_FLUKA, 24500_FLUKA, EINECS 203-981-5, CID8192, NSC 57107, NSC57107, LS-554, NCGC00091867-01, InChI=1/C12H25Cl/c1-2-3-4-5-6-7-8-9-10-11-12-13/h2-12H2,1H

Molecular Formula: C12H25ClMolecular Weight: 204.779900 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: YAYNEUUHHLGGAH-UHFFFAOYSA-N

• N-Acetyl-L-Glutamic Acid AJI92
IUPAC Name: (2S)-2-acetamidopentanedioic acid | CAS Registry Number: 1188-37-0
Synonyms: acetylglutamic acid, N-Acetylglutamate, N-acetyl-L-glutamate, N-Acetyl-L-glutamic acid, Acetyl glutamic acid, N-acetylglutamic acid, L-N-Acetylglutamic acid, Spectrum_000981, Spectrum2_001349, Spectrum3_001397, Spectrum4_000892, Spectrum5_001040, L-Glutamic acid, N-acetyl-, BSPBio_003014, KBioGR_001324, KBioSS_001461, DivK1c_000406, SPECTRUM1500703, SPBio_001537, 855642_ALDRICH

Molecular Formula: C7H11NO5Molecular Weight: 189.165940 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 5

InChIKey: RFMMMVDNIPUKGG-YFKPBYRVSA-N

• N-Butyl Chloride
IUPAC Name: 1-chlorobutane | CAS Registry Number: 109-69-3
Synonyms: 1-Chlorobutane, Butyl chloride, Butane, 1-chloro-, Sure Shot, N-BUTYL CHLORIDE, NBC wormer, Chlorobutane, 1-, Chlorure de butyle, N-Propylcarbinyl chloride, sJPHADIJuP@, 1-CHLORO-BUTANE, Chlorure de butyle [French], CCRIS 1389, NCI-C06155, WLN: G4, HSDB 4167, 125008_ALDRICH, 414255_ALDRICH, 496170_ALDRICH, NSC 8419

Molecular Formula: C4H9ClMolecular Weight: 92.567260 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: VFWCMGCRMGJXDK-UHFFFAOYSA-N

• n-Octyl Chloride
IUPAC Name: 1-chlorooctane | CAS Registry Number: 111-85-3
Synonyms: n-Octyl chloride, Octyl chloride, Capryl chloride, Octane, 1-chloro-, 1-Octyl chloride, 1-CHLOROOCTANE, 125156_ALDRICH, 442261_SUPELCO, HSDB 5551, NSC5406, NSC 5406, EINECS 203-915-5, InChI=1/C8H17Cl/c1-2-3-4-5-6-7-8-9/h2-8H2,1H, 57214-71-8

Molecular Formula: C8H17ClMolecular Weight: 148.673580 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: CNDHHGUSRIZDSL-UHFFFAOYSA-N

• n-Propyl Chloride
IUPAC Name: 1-chloropropane | CAS Registry Number: 540-54-5
Synonyms: N-Propyl chloride, Propyl chloride, Propane, 1-chloro-, 1-CHLOROPROPANE, 1-CHLORO-PROPANE, Hydrocarbons, C3, chloro, C68555_ALDRICH, HSDB 5681, 02488_FLUKA, EINECS 208-749-7, UN1278, BRN 1730771, AI3-28788, LS-119655, ST5214544, Propyl chloride [UN1278] [Flammable liquid], InChI=1/C3H7Cl/c1-2-3-4/h2-3H2,1H, Propyl chloride [UN1278] [Flammable liquid], 4-01-00-00189 (Beilstein Handbook Reference), 68390-96-5

Molecular Formula: C3H7ClMolecular Weight: 78.540680 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: SNMVRZFUUCLYTO-UHFFFAOYSA-N

• Odb-2 (Senor-2) Color Formers
IUPAC Name: 2'-(anilino)-6'-(dibutylamino)-3'-methylspiro[2-benzofuran-3,9'-xanthene]-1-one | CAS Registry Number: 89331-94-2
Synonyms: STOCK1S-56978, TL8005770, 2-phenylamino-3-methyl-6-di-n-butylaminofluoran, 2'-anilino-6'-(dibutylamino)-3'-methyl-3H-spiro[2-benzofuran-1,9'-xanthen]-3-one, Spiro[isobenzofuran-1(3H),9'-[9H]xanthen]-3-one-6'-(dibutylamino)-3'-methyl-2'-(phenylamino)-

Molecular Formula: C35H36N2O3Molecular Weight: 532.671940 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: XAAILNNJDMIMON-UHFFFAOYSA-N

• Pixantrone
IUPAC Name: 6,9-bis(2-aminoethylamino)benzo[g]isoquinoline-5,10-dione | CAS Registry Number: 144510-96-3
Synonyms: 6,9-Aea-biqdo, UNII-F5SXN2KNMR, Pixantrone (USAN/INN), CHEBI:380181, BBR 2778, CID134019, D05522, 6,9-bis(2-aminoethylamino)benzo[g]isoquinoline-5,10-dione, 5,8-Bis((2-aminoethyl)amino)-2-aza-anthracene-9,10-dione, 6,9-Bis((2-aminoethyl)amino)benz(g)isoquinoline-5,10-dione, 6,9-Bis((2-aminoethyl)amino)benzo(g)isoquinoline-5,10-dione, 6,9-Bis-(2-amino-ethylamino)-benzo[g]isoquinoline-5,10-dione, Benz(g)isoquinoline-5,10-dione, 6,9-bis((2-aminoethyl)amino)-

Molecular Formula: C17H19N5O2Molecular Weight: 325.365060 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 7

InChIKey: PEZPMAYDXJQYRV-UHFFFAOYSA-N

• Prasugrel
IUPAC Name: [5-[2-cyclopropyl-1-(2-fluorophenyl)-2-oxoethyl]-6,7-dihydro-4H-thieno[3,2-c]pyridin-2-yl] acetate | CAS Registry Number: 150322-43-3
Synonyms: Effient, Efient, Prasugrel [INN], CS 747, CS-747, CID6918456, LY-640315, Ethanone, 2-(2-(acetyloxy)-6,7-dihydrothieno(3,2-c)pyridin-5(4H)-yl)-1-cyclopropyl-2-(2-fluorophenyl)-

Molecular Formula: C20H20FNO3SMolecular Weight: 373.441103 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: DTGLZDAWLRGWQN-UHFFFAOYSA-N

• Probucol
IUPAC Name: 2,6-ditert-butyl-4-[2-(3,5-ditert-butyl-4-hydroxyphenyl)sulfanylpropan-2-ylsulfanyl]phenol | CAS Registry Number: 23288-49-5
Synonyms: probucol, Lorelco, Biphenabid, Bisphenabid, Lesterol, Lurselle, Lursell, Panavir, Bisbid, Superlipid, Sinlestal, Prestwick_408, Probucolum [INN-Latin], Spectrum_001296, LORELCO (TN), Prestwick0_000384, Prestwick1_000384, Prestwick2_000384, Prestwick3_000384, Spectrum2_001400

Molecular Formula: C31H48O2S2Molecular Weight: 516.841620 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: FYPMFJGVHOHGLL-UHFFFAOYSA-N

• R-(-)-1-aminoindan Hydrochloride Salt
IUPAC Name: (1R)-2,3-dihydro-1H-inden-1-amine;hydrochloride | CAS Registry Number: 10305-73-4
Synonyms: (R)-(-)-1-Aminoindane hydrochloride, (R)-1-aminoindane hydrochloride, SBB070154, (R)-2,3-Dihydro-1H-inden-1-amine hydrochloride, SureCN1947318, KSC496G2T, CTK3J6329, MolPort-008-155-995, (R)-(-)-1-Aminoindanehydrochloride, (R)-(-)-1-AMINOINDANE HCL, AKOS015849333, AKOS015915302, AC-5905, AM84311, AK-44891, BR-44891, KB-02718, FT-0652621, TL80090960, X8642

Molecular Formula: C9H12ClNMolecular Weight: 169.651280 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 1

InChIKey: RHAAGWRBIVCBSY-SBSPUUFOSA-N

• Rasagiline Mesylate
IUPAC Name: methanesulfonic acid; (1R)-N-prop-2-ynyl-2,3-dihydro-1H-inden-1-amine | CAS Registry Number: 161735-79-1
Synonyms: Azilect, Rasagiline mesylate, Agilect, Rasagiline mesilate, Azilect (TN), Rasagiline methanesulfonate, Rasagiline mesylate [USAN], Rasagiline mesylate (USAN), TVP-1012, TVP 1012, (+)-AGN-1135, LS-186552, D02562, (R)-N-2-Propynyl-1-indanamine methanesulfonate, 1H-Inden-1-amine, 2,3-dihydro-N-2-propynyl-, (R)-, methanesulfonate

Molecular Formula: C13H17NO3SMolecular Weight: 267.343980 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: JDBJJCWRXSVHOQ-UTONKHPSSA-N

• Sec-Butyl chloride
IUPAC Name: 2-chlorobutane | CAS Registry Number: 78-86-4
Synonyms: sec-Butyl chloride, Butane, 2-chloro-, 2-CHLOROBUTANE, sJPHADILuP@, 1-Methylpropyl chloride, (+/-)-2-Chlorobutane, C28898_ALDRICH, Butane, 2-chloro-, (R)-, Alkanes, C11-14, 2-chloro, EINECS 201-151-7, UN1127, BRN 1718770, Butane, 2-chloro-, (.+/-.)-, LS-45626, 2-Chlorobutane [UN1127] [Flammable liquid], 2-Chlorobutane [UN1127] [Flammable liquid], 3-01-00-00277 (Beilstein Handbook Reference), 53178-20-4, 68990-22-7

Molecular Formula: C4H9ClMolecular Weight: 92.567260 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: BSPCSKHALVHRSR-UHFFFAOYSA-N

• Sitafloxacin
IUPAC Name: 7-[(4S)-4-amino-6-azaspiro[2.4]heptan-6-yl]-8-chloro-6-fluoro-1-[(2S)-2-fluorocyclopropyl]-4-oxoquinoline-3-carboxylic acid | CAS Registry Number: 127254-12-0
Synonyms: Sitafloxacin [INN], DU 6859A, DU 6859, DU-6859, LS-184401, C11248, (-)-7-((7S)-Amino-5-azaspiro(2,4)hept-5-yl)-8-chloro-6-fluoro-1-((1R,2S)-2-fluorocyclopropyl)-1,4-dihydro-4-oxoq-3-uinolonecarboxylic acid, 3-Quinolinecarboxylic acid, 7-((7S)-7-amino-5-azaspiro(24)hept-5-yl)-8-chloro-6-fluoro-1-((1R,2S)-2-fluorocyclopropyl)-1,4-dihydro-4-oxo-, 3-Quinolinecarboxylic acid, 7-(7-amino-5-azaspiro(2.4)hept-5-yl)-8-chloro-6-fluoro-1-(2-fluorocyclopropyl)-1,4-dihydro-4-oxo-, (1R-(1alpha(S*),2alpha))-, 7-((7S)-Amino-5-azaspiro(2,4)heptan-5-yl)-8-chloro-6-fluoro-1-((1R,2R)-cis-2-fluoro-1-cyclopropyl)-1,4-dihydro-4-oxoquinolone-3-carboxylic acid, 7-(7-Amino-5-azaspiro(2.4)heptan-5-yl)-8-chloro-6-fluoro-1-(2-fluorocyclopropyl)-1,4-dihydro-4-oxo-3-quinolinecarboxylic acid sesquihydrate, 155421-11-7, 163157-04-8, 167355-47-7

Molecular Formula: C19H18ClF2N3O3Molecular Weight: 409.814326 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 8

InChIKey: PNUZDKCDAWUEGK-RDWQBYKPSA-N

• Sitagliptin Base
IUPAC Name: (3R)-3-amino-1-[3-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl]-4-(2,4,5-trifluorophenyl)butan-1-one | CAS Registry Number: 486460-32-6
Synonyms: Sitagliptin, Sitagliptan, Sitagliptin phosphate, Januvia (merck & Co.), BSPBio_002262, CHEBI:40237, 1x70, MK-0431, CID4369359, DB01261, LS-187389, (2R)-4-OXO-4-[3-(TRIFLUOROMETHYL)-5,6-DIHYDRO[1,2,4]TRIAZOLO[4,3-A]PYRAZIN-7(8H)-YL]-1-(2,4,5-TRIFLUOROPHENYL)BUTAN-2-AMINE, (3R)-3-amino-1-[3-(trifluoromethyl)-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl]-4-(2,4,5-trifluorophenyl)butan-1-one, (3R)-3-amino-1-[3-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[3,4-c]pyrazin-7-yl]-4-(2,4,5-trifluorophenyl)butan-1-one

Molecular Formula: C16H15F6N5OMolecular Weight: 407.313619 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 10

InChIKey: MFFMDFFZMYYVKS-SECBINFHSA-N

• Tertiary Butyl Chloride
IUPAC Name: 2-chloro-2-methylpropane | CAS Registry Number: 507-20-0
Synonyms: tert-Butyl chloride, 2-Chloro-2-methylpropane, tert-Butylchloride, 2-Chloroisobutane, t-Butylchloride, Chlorotrimethylmethane, Trimethylchloromethane, Propane, 2-chloro-2-methyl-, 2-Methyl-2-chloropropane, sJPHADIMUP@, Tertiary-butyl chloride, 2-Methyl-2-propyl chloride, T-BUTYL CHLORIDE, 2-Chloro-2-methyl-propane, C56352_ALDRICH, Propane, 2-chloro-2-methyl, NSC 6527, 08680_FLUKA, 19780_FLUKA, EINECS 208-066-4

Molecular Formula: C4H9ClMolecular Weight: 92.567260 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: NBRKLOOSMBRFMH-UHFFFAOYSA-N

• Thieno[3,2-c]pyridin-2(4H)-one, 5,6,7,7a-tetrahydro-, hydrochloride
IUPAC Name: 5,6,7,7a-tetrahydro-4H-thieno[3,2-c]pyridin-2-one;hydrochloride | CAS Registry Number: 115473-15-9
Synonyms: 5,6,7,7a-tetrahydrothieno[3,2-C]pyridine-2(4H)-one Hydrochloride, 5,6,7,7a-tetrahydrothieno[3,2-c]pyridin-2(4H)-one hydrochloride, 5,6,7,7a-Tetrahydrothieno[3,2-c]pyridine-2(4H)-onehydrochloride, 5,6,7,7a-Tetrahydrothieno(3,2-c)pyridine-2(4H)-one HCl, 5,6,7,7a-tetrahydrothieno(3,2-c)pyridine-2(4h)-one hydrochloride, 5,6,7,7A-TETRAHYDROTHIENO[3,2-C]PYRIDINE-2(4H)-ONE HCL, zlchem 147, PubChem22143, SureCN24450, ACMC-1C7KU, athienocpyridinonehydrochloride, CTK0I3373, ZLB0136, ACT06209, ANW-50996, FC1326, SBB091353, AKOS005073562, AG-D-36522, MCULE-3124302392

Molecular Formula: C7H10ClNOSMolecular Weight: 191.678400 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: PUQKTVAKLPDUAW-UHFFFAOYSA-N

• Tolvaptan
IUPAC Name: N-[4-(7-chloro-5-hydroxy-2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl)-3-methylphenyl]-2-methylbenzamide | CAS Registry Number: 150683-30-0
Synonyms: Samsca, benzazepine derivative, 32, OPC-41061, CHEBI:327437, OPC 41061, UNII-21G72T1950, CID216237, PDSP1_001738, PDSP2_001721, C116664, L001628, 7-Chloro-5-hydroxy-1-(2-methyl-4-(2-methylbenzoylamino)benzoyl)2,3,4,5-tetrahydro-1H-1-benzazepine, ( -)-4'-((7-Chloro-2,3,4,5-tetrahydro-5-hydroxy-1H-1-benzazepin-1-yl)carbonyl)-o-tolu-m-toluidide, N-[4-(7-Chloro-5-hydroxy-2,3,4,5-tetrahydro-benzo[b]azepine-1-carbonyl)-3-methyl-phenyl]-2-methyl-benzamide

Molecular Formula: C26H25ClN2O3Molecular Weight: 448.941300 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: GYHCTFXIZSNGJT-UHFFFAOYSA-N

• ULIPRISTAL
IUPAC Name: (8S,11R,13R,17R)-17-acetyl-11-(4-dimethylaminophenyl)-17-hydroxy-13-methyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one | CAS Registry Number: 159811-51-5

Molecular Formula: C28H35NO3Molecular Weight: 433.582400 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: HKDLNTKNLJPAIY-DEWOJTDQSA-N

• Ulipristal acetate
IUPAC Name: (8S,13S,14S,17R)-13-methyl-17-(2-methyl-1,3-dioxolan-2-yl)spiro[1,2,4,6,7,8,12,14,15,16-decahydrocyclopenta[a]phenanthrene-3,2'-1,3-dioxolane]-17-ol | CAS Registry Number: 54201-84-2
Synonyms: SCHEMBL544778, EBD304057, 17alpha-hydroxy-19-norpregna-5(10),9(11)-diene-3,20-dione 3,20-bis(ethylene acetal)

Molecular Formula: C24H34O5Molecular Weight: 402.523760 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: VTRLTZGPHRKHDY-MDAIXWLXSA-N

• Ulipristal-Acetate
IUPAC Name: [(8S,11R,13S,14S,17R)-17-acetyl-11-(4-dimethylaminophenyl)-13-methyl-3-oxo-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl] acetate | CAS Registry Number: 126784-99-4
Synonyms: uliprisnil acetate, Ulipristal acetate, Hrp-2000, HRP 2000, CHEBI:531376, CDB 2914, CID130904, VA 2914, RTI 3021-012, RU 44675, 17-Acetoxy-11-(4-N,N-dimethylaminophenyl)pregna-4,9-diene-3,20-dione, (11beta)-17-(Acetyloxy)-11-(4-(dimethylamino)phenyl)-19-norpregna-4,9-diene-3,20-dione, 136960-00-4, 19-Norpregna-4,9-diene-3,20-dione, 17-(acetyloxy)-11-(4-(dimethylamino)phenyl)-, (11beta)-, 199015-61-7

Molecular Formula: C30H37NO4Molecular Weight: 475.619080 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: OOLLAFOLCSJHRE-ZHAKMVSLSA-N

• 1-Chloropentane
IUPAC Name: 1-chloropentane | CAS Registry Number: 543-59-9
Synonyms: n-Amyl chloride, Pentyl chloride, Amyl chloride, 1-CHLOROPENTANE, Pentane, 1-chloro-, n-Pentyl chloride, 1-Chloro-pentane, Pentane, chloro-, n-Butylcarbonyl chloride, nchembio.205-comp19, WLN: G5, 238376_ALDRICH, 25769_FLUKA, 25770_FLUKA, HSDB 1071, NSC7898, CHEBI:362079, CID10977, NSC 7898, EINECS 208-846-4

Molecular Formula: C5H11ClMolecular Weight: 106.593840 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: SQCZQTSHSZLZIQ-UHFFFAOYSA-N

• (1S)-4,5-Dimethoxy-1-[(methylamino)methyl]benzocyclobutane
IUPAC Name: 1-[(7S)-3,4-dimethoxy-7-bicyclo[4.2.0]octa-1,3,5-trienyl]-N-methylmethanamine;hydrochloride | CAS Registry Number: 866783-13-3
Synonyms: (1S)-4,5-Dimethoxy-1-[(methylamino)methyl]benzocyclobutane hydrochloride, SureCN385259, CTK8B4485, MolPort-009-199-983, ANW-45256, AKOS015907626, AC-5503, RP28619, AK-44950, KB-00782, AB1008543, ST51054810, X0048, A20090, I14-2897, (1S)-4,5-Dimethoxy-1-(methylamino)methylbenzocyclobutane hydrochloride, (7S)-3,4-Dimethoxy-N-methylbicyclo[4.2.0]octa-1,3,5-triene-7-methanamine hydrochloride

Molecular Formula: C12H18ClNO2Molecular Weight: 243.729820 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: SWSAIQSQSDOONK-SBSPUUFOSA-N

• 4,5-Dimethoxy-1-cyanobenzocyclobutane
IUPAC Name: 3,4-dimethoxybicyclo[4.2.0]octa-1,3,5-triene-8-carbonitrile | CAS Registry Number: 35202-54-1
Synonyms: NSC154410, AIDS127272, AIDS-127272, CID290544, NSC 154410, 3,4-Dimethoxybicyclo[4.2.0]octa-1,3,5-triene-7-carbonitrile, 3,4-Dimethoxybicyclo(4.2.0)octa-1,3,5-triene-7-carbonitrile

Molecular Formula: C11H11NO2Molecular Weight: 189.210540 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: HJTHVTHXHHFXMJ-UHFFFAOYSA-N

• 1,3-Dihydro-7,8-dimethoxy-2H-3-benzazepin-2-one
IUPAC Name: 7,8-dimethoxy-1,3-dihydro-3-benzazepin-2-one | CAS Registry Number: 73942-87-7
Synonyms: 7,8-dimethoxy-1,3-dihydro-2H-3-benzazepin-2-one, AG-G-93268, 7,8-dimethoxy-1,3-dihydro-3-benzazepin-2-one, ZINC01395725, AC1LS4UO, SureCN333847, MLS000720765, CTK5D8984, MolPort-002-876-113, HMS2708E18, ANW-54124, SBB095768, STL373037, AKOS015951200, AC-4648, MCULE-4639716156, RP27193, AK-40687, KB-10384, SMR000336763

Molecular Formula: C12H13NO3Molecular Weight: 219.236520 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: CPNZASIAJKSBBH-UHFFFAOYSA-N

• 7,8-Dimethoxy-1,3,4,5-Tetrahydrobenzo[d]azepin-2-One
IUPAC Name: 7,8-dimethoxy-1,2,3,5-tetrahydro-3-benzazepin-4-one | CAS Registry Number: 20925-64-8
Synonyms: 7,8-DIMETHOXY-1,3,4,5-TETRAHYDROBENZO[D]AZEPIN-2-ONE, AG-E-53636, 7,8-Dimethoxy-1,3,4,5-tetrahydro-2H-benzazepin-2-one, 1,3,4,5-Tetrahydro-7,8-dimethoxy-2H-3-benzazepin-2-one, 7,8-dimethoxy-1,3,4,5-tetrahydro-2H-3-benzazepin-2-one, 2H-3-BENZAZEPIN-2-ONE, 1,3,4,5-TETRAHYDRO-7,8-DIMETHOXY-, PubChem21052, SureCN24795, AGN-PC-008DPO, Oprea1_332723, CTK1A1991, MolPort-003-804-990, AC1Q4712, ANW-44761, ZINC05720277, AKOS015951199, AC-4649, MCULE-2667343881, AK-40393, KB-46020

Molecular Formula: C12H15NO3Molecular Weight: 221.252400 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: RXKTVGMZJMDNLF-UHFFFAOYSA-N

• 7,8-Dimethoxy-3-(3-Chloropropyl)-1,3-Dihydro-2h-3-Benzazepin-2-One
IUPAC Name: 3-(3-chloropropyl)-7,8-dimethoxy-1H-3-benzazepin-2-one | CAS Registry Number: 85175-59-3
Synonyms: 3-(3-Chloropropyl)-1,3-dihydro-7,8-dimethoxy-2H-3-benzazepin-2-one, 3-(3-Chloro-propyl)-7,8-dimethoxy-1, 2H-3-Benzazepin-2-one, 3-(3-chloropropyl)-1,3-dihydro-7,8-dimethoxy-, AGN-PC-00KUS9, SureCN2450139, CTK5F4411, MolPort-005-943-402, ,3-dihydro-benzo[d]azepin-2-one, ANW-44866, SBB070944, ZINC22007307, AKOS015907757, AC-1910, AG-H-42249, AK-40689, AB1008546, KB-177760, AM20090733, FT-0655534, X4819

Molecular Formula: C15H18ClNO3Molecular Weight: 295.761320 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: ODEZTTCXWTUAJT-UHFFFAOYSA-N

• 4-Bromo-2-Chloro-6-Methylaniline
IUPAC Name: 4-bromo-2-chloro-6-methylaniline | CAS Registry Number: 30273-42-8
Synonyms: 4-Bromo-2-chloro-6-methylaniline, ST50408844, 4-Bromo-6-chloro-o-toluidine, ZINC05227618, PubChem23742, AC1MCHA3, AC1Q2HKA, ACMC-20a53i, SureCN999991, 648752_ALDRICH, 652938_ALDRICH, CTK4G4764, MolPort-001-792-809, ANW-57532, BBL025703, GEO-00405, STL367721, 4-bromo-6-chloro-2-methylphenylamine, AKOS000447133, 4-Bromo-2-chloro-6-methyl-phenylamine

Molecular Formula: C7H7BrClNMolecular Weight: 220.494180 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: DIXGIKZIIZRFKE-UHFFFAOYSA-N

• 11-Hydroxy Canrenone
IUPAC Name: (10R,11R,13S,17R)-11-hydroxy-10,13-dimethylspiro[2,8,9,11,12,14,15,16-octahydro-1H-cyclopenta[a]phenanthrene-17,5'-oxolane]-2',3-dione | CAS Registry Number: 192569-17-8
Synonyms: 11|A-Hydroxy Canrenone, SureCN14284936, AKOS015967424, (11|A,17|A)-11,17-Dihydroxy-3-oxopregna-4,6-diene-21-carboxylic Acid |A-Lactone

Molecular Formula: C22H28O4Molecular Weight: 356.455320 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: RJTDWMKVQUPGSY-GOAYFHFKSA-N

• 2-chloro-1-cyclopropyl-2-(2-fluorophenyl)-Ethanone
IUPAC Name: 2-chloro-1-cyclopropyl-2-(2-fluorophenyl)ethanone | CAS Registry Number: 178688-43-2
Synonyms: 2-CHLORO-1-CYCLOPROPYL-2-(2-FLUOROPHENYL)ETHANONE, AG-E-28849, Ethanone, 2-chloro-1-cyclopropyl-2-(2-fluorophenyl)-, ETH109, CTK4D6856, ANW-44179, AKOS015854318, AK-88858, BD228537, KB-229364, X6147, Ethanone,2-chloro-1-cyclopropyl-2-(2-fluorophenyl)-, I14-32730, 2-CHLORO-1-CYCLOPROPYL-2-(2-FLUOROPHENYL)-ETHANONE

Molecular Formula: C11H10ClFOMolecular Weight: 212.647903 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: PUSSGWBQJBLHJL-UHFFFAOYSA-N

• (1R,1'R)-2,2'-(3,11-Dioxo-4,10-Dioxatridecamethylene)-Bis-(1,2,3,4-Tetrahydro-6,7-Dimethoxy-1-Veratrylisoquindline)-Dioxalate
IUPAC Name: 5-[3-[(1R)-1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]propanoyloxy]pentyl 3-[(1R)-1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]propanoate;oxalic acid | CAS Registry Number: 96687-52-4
Synonyms: CisAtracurium Oxalate, RL06086

Molecular Formula: C55H70N2O20Molecular Weight: 1079.145700 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 22

InChIKey: NGJVDNJEQWIMBU-DBGKOQSZSA-N

• 3-[2-(1,3-Dioxolan-2-Yl)ethyl]-7,8-Dimethoxy-1,3,4,5-Tetrahydro-2H-3-Benzazepin-2-One
IUPAC Name: 3-[2-(1,3-dioxolan-2-yl)ethyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one | CAS Registry Number: 866462-51-3
Synonyms: 3-[2-(1,3-Dioxolan-2-yl)ethyl]-7,8-dimethoxy-1,3,4,5-tetrahydro-2H-3-benzazepin-2-one, 3-(2-(1,3-Dioxolan-2-yl)ethyl)-7,8-dimethoxy-4,5-dihydro-1H-benzo[d]azepin-2(3H)-one, AGN-PC-00AO4X, SureCN2443618, CTK5F7050, ANW-62208, AKOS015917687, AG-H-49487, AK102348, KB-180130, AM20090718, I14-8829, 2H-3-Benzazepin-2-one,3-[2-(1,3-dioxolan-2-yl)ethyl]-1,3,4,5-tetrahydro-7,8-dimethoxy-, 3-[2-(1,3-dioxolan-2-yl)ethyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one, 2H-3-Benzazepin-2-one, 3-[2-(1,3-dioxolan-2-yl)ethyl]-1,3,4,5-tetrahydro-7,8-dimethoxy-

Molecular Formula: C17H23NO5Molecular Weight: 321.368220 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: WBLSXQWVJABURL-UHFFFAOYSA-N

• 1,5-Pentanediol Diacrylate
IUPAC Name: 5-prop-2-enoyloxypentyl prop-2-enoate | CAS Registry Number: 36840-85-4
Synonyms: 1,5-Pentanediol diacrylate, 1,5-Pentanediyl diacrylate, CCRIS 7043, EINECS 253-235-8, MolPort-000-005-718, CID93195, LS-188581

Molecular Formula: C11H16O4Molecular Weight: 212.242340 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: XAMCLRBWHRRBCN-UHFFFAOYSA-N

• 3-(3-chloropropyl)-7,8-dimethoxy-1,3,4,5-tetrahydro-2H-3-benzazepin-2-one
IUPAC Name: 3-(3-chloropropyl)-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one | CAS Registry Number: 85175-65-1
Synonyms: 3-(3-Chloropropyl)-7,8-dimethoxy-4,5-dihydro-1H-benzo[d]azepin-2(3H)-one, AGN-PC-00KUSE, SureCN9032662, AKOS016012096, AK120375, KB-232930, 3-(3-chloropropyl)-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one

Molecular Formula: C15H20ClNO3Molecular Weight: 297.777200 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: UKLLLQWDPVQNPO-UHFFFAOYSA-N

• (17a)-3,3-[1,2-Ethanediylbis-(oxy)]-17-hydroxyestra-5(10),9(11)-diene-17-carbonitrile
IUPAC Name: (8S,13S,14S,17R)-17-hydroxy-13-methylspiro[1,2,4,6,7,8,12,14,15,16-decahydrocyclopenta[a]phenanthrene-3,2'-1,3-dioxolane]-17-carbonitrile | CAS Registry Number: 33300-19-5
Synonyms: SCHEMBL3327968, ZINC97978700, AKOS025401808, AC-25787, 3-Ethylenedioxy-17beta-cyano-17alpha-hydroxyestra-5(10),9(11)-diene, 17-Hydroxy-3-oxoestra-5(10),9(11)-diene-17beta-carbonitrile cyclic ethylene acetal

Molecular Formula: C21H27NO3Molecular Weight: 341.451 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: ITBGBOBQGVJJRT-FYQPLNBISA-N

• 7-chloro-1-[2-methyl-4-[(2-methylbenzoyl)amino]benzoyl]-5-oxo-2,3,4,5-tetrahydro-1H-1-benzazepine
IUPAC Name: N-[4-(7-chloro-5-oxo-3,4-dihydro-2H-1-benzazepine-1-carbonyl)-3-methylphenyl]-2-methylbenzamide | CAS Registry Number: 137973-76-3
Synonyms: N-(4-(7-Chloro-5-oxo-2,3,4,5-tetrahydro-1H-benzo[b]azepine-1-carbonyl)-3-methylphenyl)-2-methylbenzamide, SureCN533754, AGN-PC-007LC2, CTK8C1829, ANW-67326, AKOS016006852, AK-89104, N-[4-(7-chloro-5-oxo-3,4-dihydro-2H-1-benzazepine-1-carbonyl)-3-methylphenyl]-2-methylbenzamide, N-[4-[(7-CHLORO-2,3,4,5-TETRAHYDRO-5-OXO-1H-1-BENZAZEPIN-1-YL)CARBONYL]-3-METHYLPHENYL]-2-METHYLBENZAMIDE

Molecular Formula: C26H23ClN2O3Molecular Weight: 446.925420 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: VENGMROMZOKURN-UHFFFAOYSA-N

• 7-Chloro-1,2,3,4-tetrahydrobenzo[b]azepin-5-one
IUPAC Name: 7-chloro-1,2,3,4-tetrahydro-1-benzazepin-5-one | CAS Registry Number: 160129-45-3
Synonyms: 7-chloro-1,2,3,4-tetrahydrobenzo[b]azepin-5-one, 7-CHLORO-1,2,3,4-TETRAHYDRO-BENZO[B]AZEPIN-5-ONE, 7-chloro-1,2,3,4-tetrahydro-1-benzazepin-5-one, 7-Chloro-1,2,3,4-tetrahydro-5H-1-benzazepin-5-one, 7-CHLORO-1,2,3,4-TETRAHYDRO-5H-1-BENZOZEPIN-5-ONE, 7-CHLORO-3,4-DIHYDRO-1H-BENZO[B]AZEPIN-5(2H)-ONE, PubChem17352, ACMC-1C1GW, SureCN533885, KSC497C1J, CTK3J7114, MolPort-008-266-740, ACT01821, ANW-50617, SBB068323, WTI-10458, ZINC40448843, 7-CHLOROBENZO[B]AZEPAN-5-ONE, AKOS006292617, AG-E-09557

Molecular Formula: C10H10ClNOMolecular Weight: 195.645500 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: AHESNFIUAHTYGS-UHFFFAOYSA-N


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