Shanghai Twisun Bio-Pharm Co., Ltd.

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Profile: Shanghai Twisun Bio-Pharm Co., Ltd. specializes in providing active pharmaceutical ingredients & fine chemicals. Our active pharmaceutical ingredients include dabigatran etexilate, clopidogrel, 2-aminoethylmethylsulfone hydrochloride, capecitabine, dasatinib monohydrate, and lapatinib ditosylate. Nalarabine is used as an anti-cancer agent. Ethyl 3-ethoxyacrylate is used as cyclization agent.

40 Products/Chemicals (Click for related suppliers)

• Avanafil

IUPAC Name: 4-[(3-chloro-4-methoxyphenyl)methylamino]-2-[2-(hydroxymethyl)pyrrolidin-1-yl]-N-(pyrimidin-2-ylmethyl)pyrimidine-5-carboxamide | CAS Registry Number: 330784-47-9
Synonyms: UNII-DR5S136IVO, TA 1790, 330785-17-6, 5-Pyrimidinecarboxamide, 4-(((3-chloro-4-methoxyphenyl)methyl)amino)-2-((2S)-2-(hydroxymethyl)-1-pyrrolidinyl)-N-(2-pyrimidinylmethyl)-, 647841-09-6

Molecular Formula:	C₂₃H₂₆ClN₇O₃	Molecular Weight:	483.950640 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	9

InChIKey: WEAJZXNPAWBCOA-UHFFFAOYSA-N

• Axitinib

IUPAC Name: N-methyl-2-[[3-[(E)-2-pyridin-2-ylethenyl]-1H-indazol-6-yl]sulfanyl]benzamide | CAS Registry Number: 319460-85-0
Synonyms: Axitinib [USAN], AG-013736, CID6450551, AG-13736, AG 013736, Benzamide, N-methyl-2-((3-((1E)-2-(2-pyridinyl)ethenyl)-1H-indazo)-6-yl)thio)-, N-methyl-2-((3-((1E)-2-(pyridin-2-yl)ethenyl)-1H-indazol-6-yl)sulfanyl)benzamide, 790713-39-2

Molecular Formula:	C₂₂H₁₈N₄OS	Molecular Weight:	386.469520 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: RITAVMQDGBJQJZ-FMIVXFBMSA-N

• Benzene, 4-bromo-1-chloro-2-[(4-ethoxyphenyl)methyl]-

IUPAC Name: 4-bromo-1-chloro-2-[(4-ethoxyphenyl)methyl]benzene | CAS Registry Number: 461432-23-5
Synonyms: 4-bromo-1-chloro-2-(4-ethoxybenzyl)benzene, SBB054221, 4-(5-Bromo-2-chlorobenzyl)phenyl ethyl ether, PubChem19265, SureCN38150, AGN-PC-0CTD6H, BEN221, CTK1D5537, MolPort-008-266-773, ACN-S002204, AMX10146, ANW-66595, ZINC34781172, AKOS015917373, AG-B-99330, AK-37459, KB-41979, 5-Bromo-2-chloro-4'-ethoxydiphenylmethane, 2-(4-ethoxybenzyl)-4-bromo-1-chlorobenzene, AM20040524

Molecular Formula:	C₁₅H₁₄BrClO	Molecular Weight:	325.628060 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: ZUNCHZBITMUSRD-UHFFFAOYSA-N

• Capecitabine

IUPAC Name: pentyl N-[1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-methyloxolan-2-yl]-5-fluoro-2-oxopyrimidin-4-yl]carbamate | CAS Registry Number: 154361-50-9
Synonyms: Xeloda, CAPECITABINE, Capecitabine [USAN], Xeloda (TN), Capecitabine (JAN/USAN/INN), C15H22FN3O6, Ro 09-1978, DB01101, Ro-09-1978, LS-59070, N(4)-Pentyloxycarbonyl-5'-deoxy-5-fluorocytidine, Ro 09-1978/000, R-340, 5'-Deoxy-5-fluoro-N-((pentyloxy)carbonyl)cytidine, C12650, D01223, C110904, Cytidine, 5'-deoxy-5-fluoro-N-((pentyloxy)carbonyl)-, Pentyl 1-(5-deoxy-beta-D-ribofuranosyl)-5-fluoro-1,2-dihydro-2-oxo-4-pyrimidinecarbamate, Carbamic acid, (1-(5-deoxy-beta-D-ribofuranosyl)-5-fluoro-1,2-dihydro-2-oxo-4-pyrimidinyl)-, pentyl ester

Molecular Formula:	C₁₅H₂₂FN₃O₆	Molecular Weight:	359.350083 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	7

InChIKey: GAGWJHPBXLXJQN-UORFTKCHSA-N

• Dabigatran etexilate

IUPAC Name: ethyl 3-[[2-[[4-[(E)-N'-hexoxycarbonylcarbamimidoyl]anilino]methyl]-1-methylbenzimidazole-5-carbonyl]-pyridin-2-ylamino]propanoate | CAS Registry Number: 211915-06-9
Synonyms: Pradaxa, Rendix, Dabigatran etexilate (INN), Dabigatran etexilate [INN], BIBR-1048MS, BIBR-1048, CID9578572, D07144, Ethyl 3-(((2-(((4-((((hexyloxy)carbonyl)amino)iminomethyl)phenyl)amino)methyl)-1-methyl-1H-benzimidazol-5-yl)carbonyl)(pyridin-2-yl)amino)propanoate

Molecular Formula:	C₃₄H₄₁N₇O₅	Molecular Weight:	627.733240 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	9

InChIKey: KSGXQBZTULBEEQ-UHFFFAOYSA-N

• Dasatinib

IUPAC Name: N-(2-chloro-6-methylphenyl)-2-[[6-[4-(2-hydroxyethyl)piperazin-1-yl]-2-methylpyrimidin-4-yl]amino]-1,3-thiazole-5-carboxamide hydrate | CAS Registry Number: 863127-77-9
Synonyms: Dasatinib hydrate, Dasatinib hydrate (JAN), D06414

Molecular Formula:	C₂₂H₂₈ClN₇O₃S	Molecular Weight:	506.020820 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	9

InChIKey: XHXFZZNHDVTMLI-UHFFFAOYSA-N

• Decitabine

IUPAC Name: 4-amino-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,3,5-triazin-2-one | CAS Registry Number: 2353-33-5
Synonyms: Dezocitidine, Dacogen, 5-Aza-2'-deoxycytidine, AzadC, 5-Azadeoxycytidine, 5-aza-CdR, 5-aza-dC, Dacogen (TN), 2'-Deoxy-5-azacytidine, 5A2dc, 5-aza-2-deoxycytidine, 5-AZAdC, NCGC_5ADOC, Decitabine (USAN/INN), MolMap_000063, MLS001332587, MLS001332588, A3656_SIGMA, 5-Aza-2′-Deoxycytidine, 5-Deoxy-2′-azacytidine

Molecular Formula:	C₈H₁₂N₄O₄	Molecular Weight:	228.205280 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	6

InChIKey: XAUDJQYHKZQPEU-KVQBGUIXSA-N

• Erlotinib

IUPAC Name: N-(3-ethynylphenyl)-6,7-bis(2-methoxyethoxy)quinazolin-4-amine | CAS Registry Number: 183321-74-6
Synonyms: Tarceva, erlotinib HCl, Erlotinib [INN], Erlotinib(Tarceva), nchembio866-comp3, OSI-774, STOCK6S-52681, CID176870, DB00530, NCGC00164574-01, BCB03_000783, CP 358774, CP-358774, LS-184395, CP 358,774, CP-358,774, K00241, C400278, N-(3-Ethynylphenyl)-6,7-bis(2-methoxyethoxy)quinazolin-4-amine, 4-Quinazolinamine, N-(3-ethynylphenyl)-6,7-bis(2-methoxyethoxy)-

Molecular Formula:	C₂₂H₂₃N₃O₄	Molecular Weight:	393.435720 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	7

InChIKey: AAKJLRGGTJKAMG-UHFFFAOYSA-N

• Ethanone, 2-bromo-1-cyclopropyl-2-(2-fluorophenyl)-

IUPAC Name: 2-bromo-1-cyclopropyl-2-(2-fluorophenyl)ethanone | CAS Registry Number: 204205-33-4
Synonyms: 2-bromo-2-(2-fluorophenyl)-1-cyclopropylethanone, 2-bromo-1-cyclopropyl-2-(2-fluorophenyl)ethanone, PubChem19832, ETH032, CTK1A1324, ANW-46083, FC1324, SBB070887, AKOS015854297, AG-E-49682, QC-8934, RP29149, AK-44978, EN000409, AB1004592, KB-168705, A4444, AM20090723, FT-0649302, I14-6513

Molecular Formula:	C₁₁H₁₀BrFO	Molecular Weight:	257.098903 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: LMCZCCDXOZGIND-UHFFFAOYSA-N

• Fine Chemicals

• Gefitinib

IUPAC Name: N-(3-chloro-4-fluorophenyl)-7-methoxy-6-(3-morpholin-4-ylpropoxy)quinazolin-4-amine | CAS Registry Number: 184475-35-2
Synonyms: Iressa, Irressat, Gefitini; Iressa, Gefitinib [USAN], Iressa (TN), nchembio866-comp14, nchembio.117-comp18, ZD1839, KBioSS_002241, Gefitinib (JAN/USAN/INN), ZD 1839, CCRIS 9011, STOCK6S-52331, CHEBI:49668, ZD-1839, CID123631, NSC715055, DB00317, NCGC00159455-02, NCGC00159455-03

Molecular Formula:	C₂₂H₂₄ClFN₄O₃	Molecular Weight:	446.902363 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	8

InChIKey: XGALLCVXEZPNRQ-UHFFFAOYSA-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:	C₂₇H₃₇ClN₂O₅	Molecular Weight:	505.046080 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	6

InChIKey: HLUKNZUABFFNQS-ZMBIFBSDSA-N

• Lapatinib

IUPAC Name: N-[3-chloro-4-[(3-fluorophenyl)methoxy]phenyl]-6-[5-[(2-methylsulfonylethylamino)methyl]furan-2-yl]quinazolin-4-amine | CAS Registry Number: 231277-92-2
Synonyms: Tykerb, Lapatinib [INN], 1xkk, Lapatinib Ditosylate, nchembio866-comp20, Lapatinib tosilate hydrate, GW572016, CHEBI:49603, GSK 572016, GW 572016, CID208908, DB01259, NCGC00167507-01, LS-187029, LS-187771, FMM, N-{3-CHLORO-4-[(3-FLUOROBENZYL)OXY]PHENYL}-6-[5-({[2-(METHYLSULFONYL)ETHYL]AMINO}METHYL)-2-FURYL]-4-QUINAZOLINAMINE, 4-Quinazolinamine, N-(3-chloro-4-((3-fluorophenyl)methoxy)phenyl)-6-(5-(((2-(methylsulfonyl)ethyl)amino)methyl)-2-furanyl)-, N-(3-chloro-4-((3-fluorophenyl)methoxy)phenyl)-6-(5-(((2-(methylsulfonyl)ethyl)amino)methyl)-2-furanyl)-4-quinazolinamine, N-(3-Chloro-4-((3-fluorophenyl)methoxy)phenyl)-6-(5-((2-methylsulfonylethylamino)methyl)-2-furyl)quinazolin-4-amine

Molecular Formula:	C₂₉H₂₆ClFN₄O₄S	Molecular Weight:	581.057543 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	9

InChIKey: BCFGMOOMADDAQU-UHFFFAOYSA-N

• Lapatinib Ditosylate

IUPAC Name: benzenesulfonic acid; N-[3-chloro-4-[(3-fluorophenyl)methoxy]phenyl]-6-[5-[(2-methylsulfonylethylamino)methyl]furan-2-yl]quinazolin-4-amine; hydrate | CAS Registry Number: 388082-78-8
Synonyms: Tykerb, Lapatinib Ditosylate [USAN], GW572016F, CID208909, LS-186595, 4-Quinazolinamine, N-(3-chloro-4-((3-fluorophenyl)methoxy)phenyl)-6-(5-(((2-(methylsulfonyl)ethyl)amino)methyl)-2-furanyl), bis(4-methylbenzenesulfonate), monohydrate, N-(3-Chloro-4-((3-fluorobenzyl)oxy)phenyl)-6-(5-(((2-(methylsulfonyl)ethyl)amino)methyl)furan-2-yl)quinazolin-4-amine bis(4-methylbenzenesulfonate) monohydrate

Molecular Formula:	C₄₁H₄₀ClFN₄O₁₁S₃	Molecular Weight:	915.422903 [g/mol]
H-Bond Donor:	5	H-Bond Acceptor:	16

InChIKey: CJCNEWWARIPAEG-UHFFFAOYSA-N

• Methanesulfonamide, N-[2-Butyl-3-[4-[3-(dibutylamino)propoxy]benzoyl]-5-Benzofuranyl]-, Hydrochloride

IUPAC Name: N-[2-butyl-3-[4-[3-(dibutylamino)propoxy]benzoyl]-1-benzofuran-5-yl]methanesulfonamide hydrochloride | CAS Registry Number: 141625-93-6
Synonyms: Dronedarone HCl, Dronedarone hydrochloride, UNII-FA36DV299Q, Dronedarone hydrochloride (USAN), CID219025, D03914, Methanesulfonamide, N-(2-butyl-3-(4-(3-(dibutylamino)propoxy)benzoyl)-5-benzofuranyl)-, monohydrochloride, N-(2-Butyl-3-(4-(3-(dibutylamino)propoxy)benzoyl)-5-benzofuranyl)methanesulfonamide monohydrochloride

Molecular Formula:	C₃₁H₄₅ClN₂O₅S	Molecular Weight:	593.217400 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	7

InChIKey: DWKVCQXJYURSIQ-UHFFFAOYSA-N

• Methanone, (5-bromo-2-chlorophenyl)(4-ethoxyphenyl)-

IUPAC Name: (5-bromo-2-chlorophenyl)-(4-ethoxyphenyl)methanone | CAS Registry Number: 461432-22-4
Synonyms: (5-BROMO-2-CHLOROPHENYL)(4-ETHOXYPHENYL)METHANONE, AG-F-59073, Methanone,(5-bromo-2-chlorophenyl)(4-ethoxyphenyl)-, PubChem19264, SureCN17019, AGN-PC-0CWZ8Z, MET048, CTK4I9196, MolPort-012-637-484, ACN-S002203, AMX10147, ANW-59625, RW4002, SBB069643, ZINC34094196, AKOS009476100, QC-2694, AK-45003, KB-78356, AM20090706

Molecular Formula:	C₁₅H₁₂BrClO₂	Molecular Weight:	339.611580 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: OEURLNJEQCLGPS-UHFFFAOYSA-N

• Mitomycin

Synonyms: mitomycin C, Ametycine, Mutamycin, Ametycin, Mitomycin-C, Mitomycinum, Mitozytrex, Mytozytrex, Mitamycin, Mytomycin, Mitocin-C, Mitomycinum C, Mitomycins, Muamycin, Mitocin C, Mito-C, Mitomycin (TN), Muamycin (TN), Mit-C, Mitomycyna C [Polish]

Molecular Formula:	C₁₅H₁₈N₄O₅	Molecular Weight:	334.327220 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	8

InChIKey: NWIBSHFKIJFRCO-WUDYKRTCSA-N

• Nilotinib

IUPAC Name: 4-methyl-N-[3-(4-methylimidazol-1-yl)-5-(trifluoromethyl)phenyl]-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]benzamide | CAS Registry Number: 641571-10-0
Synonyms: AMN107, AMN 107, CHEBI:52172, AMN-107, TL8004531, 4-methyl-N-[3-(4-methyl-1H-imidazol-1-yl)-5-(trifluoromethyl)phenyl]-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]benzamide, 4-Methyl-3-((4-(3-pyridinyl)-2-pyrimidinyl)amino)-N-(5-(4-methyl-1H-imidazol-1-yl)-3-(trifluoromethyl)phenyl)benzamide, 4-Methyl-3-(4-(3-pyridinyl)-2-pyrimidinyl)amino)-N-[5-(4-methyl-1H-imidazol-1-yl)-3-(trifluoromethyl)phenyl]benzamide, 4-Methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]-N-[5-(4-methyl-1H-imidazol-1-yl)-3-(trifluoromethyl)phenyl]benzamide, Benzamide, 4-methyl-N-((3-(4-methyl-1H-imidazol-1-yl)-5-(trifluoromethyl)phenyl)-3-(4-(3-pyridinyl)-2-pyrimidinyl)amino)-, Benzamide, 4-methyl-N-(3-(4-methyl-1H-imidazol-1-yl)-5-(trifluoromethyl)phenyl)-3-(4-(3-pyridinyl)-2-pyrimidinyl)amino)-, benzamide, 4-methyl-N-[3-(4-methyl-1H-imidazol-1-yl)-5-(trifluoromethyl)phenyl]-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]-, Benzamide, 4-methyl-N-[3-(4-methyl-1H-imidazol-1-yl)-5-(trifluoromethyl)phenyl]-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]- (9CI), NIL

Molecular Formula:	C₂₈H₂₂F₃N₇O	Molecular Weight:	529.515790 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	10

InChIKey: HHZIURLSWUIHRB-UHFFFAOYSA-N

• Paliperidone

IUPAC Name: (9R)-3-[2-[4-(6-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]ethyl]-9-hydroxy-2-methyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one | CAS Registry Number: 144598-75-4
Synonyms: Invega, Invega (TN), Paliperidone (JAN/USAN/INN), CID9802545, D05339

Molecular Formula:	C₂₃H₂₇FN₄O₃	Molecular Weight:	426.483883 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	7

InChIKey: PMXMIIMHBWHSKN-LJQANCHMSA-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:	C₂₀H₂₀FNO₃S	Molecular Weight:	373.441103 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	5

InChIKey: DTGLZDAWLRGWQN-UHFFFAOYSA-N

• Sodium Valproate

IUPAC Name: sodium 2-propylpentanoate | CAS Registry Number: 1069-66-5
Synonyms: Sodium valproate, Valproate sodium, Depakene, Epilim, Convulex, Eurekene, Labazene, Orfiril, Valerin, Natrium valproat, Selenica, Sodium 2-propylpentanoate, Valproic acid sodium salt, Dipropylacetate sodium, Sodium dipropylacetate, Depakene (TN), Selenica (TN), Sodium bispropylacetate, Valproic acid sodium, Valproinsaeure, natrium

Molecular Formula:	C₈H₁₅NaO₂	Molecular Weight:	166.193270 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: AEQFSUDEHCCHBT-UHFFFAOYSA-M

• Sunitinib

IUPAC Name: N-(2-diethylaminoethyl)-5-[(Z)-(5-fluoro-2-oxo-1H-indol-3-ylidene)methyl]-2,4-dimethyl-1H-pyrrole-3-carboxamide | CAS Registry Number: 557795-19-4
Synonyms: Sutent, Sunitanib, Sunitinib malate, PDGF TK antagonist, STOCK6S-48542, Su-011248, CHEBI:38940, SU-11248, K00588a, SU11248, NSC736511, SU-11248J, SU 11248, DB01268, NCGC00164631-01, SU-12662, LS-187023, LS-187648, 1H-Pyrrole-3-carboxamide, N-(2-(diethylamino)ethyl)-5-((Z)-(5-fluoro-1,2-dihydro-2-oxo-3H-indol-3-ylidene)methyl)-2,4-dimethyl-, 1H-Pyrrole-3-carboxamide, N-[2-(diethylamino)ethyl]-5-[(Z)- (5-fluoro-1,2-dihydro-2-oxo-3H-indol-3-ylidene)methyl]-2,4-dimethyl-

Molecular Formula:	C₂₂H₂₇FN₄O₂	Molecular Weight:	398.473783 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	5

InChIKey: WINHZLLDWRZWRT-ATVHPVEESA-N

• Ticagrelor

IUPAC Name: (1S,2S,3R,5S)-3-[7-[[(1R,2S)-2-(3,4-difluorophenyl)cyclopropyl]amino]-5-propylsulfanyltriazolo[4,5-d]pyrimidin-3-yl]-5-(2-hydroxyethoxy)cyclopentane-1,2-diol | CAS Registry Number: 274693-27-5
Synonyms: Brilinta, Brilique, AZD-6140, TICARGRELOR, AZD6140, CHEBI:68558, AR-C 126532XX, AZD 6140, (1S,2S,3R,5S)-3-(7-((1R,2S)-2-(3,4-difluorophenyl)cyclopropylamino)-5-(propylthio)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-3-yl)-5-(2-hydroxyethoxy)cyclopentane-1,2-diol, (1S,2S,3R,5S)-3-[7-[[(1R,2S)-2-(3,4-DIFLUOROPHENYL)CYCLOPROPYL]AMINO]-5-(PROPYLTHIO)-3H-1,2,3-TRIAZOLO[4,5-D]PYRIMIDIN-3-YL]-5-(2-HYDROXYETHOXY)-1,2-CYCLOPENTANEDIOL, UNII-GLH0314RVC, Possia, Brilinta (TN), (1S,2S,3R,5S)-3-(7-((1R,2S)-2-(3,4-Difluorophenyl)cyclopropylamino)-5-(propylthio)-3H-(1,2,3)triazolo(4,5-d)pyrimidin-3-yl)-5-(2-hydroxyethoxy)cyclopentane-1,2-diol, Ticagrelor (USAN/INN), SureCN1979652, GLH0314RVC, cc-291, CHEMBL398435, AR-C126532XX

Molecular Formula:	C₂₃H₂₈F₂N₆O₄S	Molecular Weight:	522.568026 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	12

InChIKey: OEKWJQXRCDYSHL-FNOIDJSQSA-N

• Vinflunine

Synonyms: Vinflunine [INN}, C45H54F2N4O8, CID157688, LS-173568, 4'-Deoxy-20',20'-difluoro-C'-norvincaleukoblastine, C'-Norvincaleukoblastine, 4'-deoxy-20',20'-difluoro-, 4'-Deoxy-20',20'-difluoro-8'-norvincaleukoblastine

Molecular Formula:	C₄₅H₅₄F₂N₄O₈	Molecular Weight:	816.929066 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	14

InChIKey: NMDYYWFGPIMTKO-ZSRSGXGDSA-N

• 4-Chloro-6-iodoquinazoline

IUPAC Name: 4-chloro-6-iodoquinazoline | CAS Registry Number: 98556-31-1
Synonyms: 4-chloro-6-iodoquinazoline, 4-chloro-6-iodo-quinazoline, 6-iodo-4-chloroquinazoline, AG-H-99951, QUINAZOLINE, 4-CHLORO-6-IODO-, AR-527/43405044, PubChem23075, CTK5H9975, MolPort-000-002-633, AMX10158, ANW-51151, ZINC02386553, AKOS015851274, PB19952, QC-1088, AK-32306, BR-32306, KB-38076, AM20090785, FT-0656664

Molecular Formula:	C₈H₄ClIN₂	Molecular Weight:	290.488230 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: BDAIUOPDSRAOKI-UHFFFAOYSA-N

• 2-aminoethylmethylsulfone Hydrochloride

IUPAC Name: 2-methylsulfonylethanamine;hydrochloride | CAS Registry Number: 104458-24-4
Synonyms: 2-Aminoethylmethylsulfone hydrochloride, 2-(methylsulfonyl)ethanamine hydrochloride, 2-Aminoethylmethylsulphone hydrochloride, SBB070078, 2-methanesulfonylethan-1-amine hydrochloride, 2-aminoethylmethylsulfone, AGN-PC-01LQRD, AC1Q3C5U, 2-(methylsulfonyl)ethaneamine, KSC494M5P, ACMC-2098c3, AES-M01-1, CTK3J4657, MolPort-001-760-137, ACN-S003783, 2-AMINOETHYLMETHYLSULFONE HCL, ANW-15073, AR2651, AKOS015849429, AG-A-36993

Molecular Formula:	C₃H₁₀ClNO₂S	Molecular Weight:	159.635000 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: AMYYUKGKCJKCBI-UHFFFAOYSA-N

• 5-Formylfuran-2-boronic Acid

IUPAC Name: (5-formylfuran-2-yl)boronic acid | CAS Registry Number: 27329-70-0
Synonyms: 5-Formyl-2-furanboronic acid, 5-formyl-2-furylboronic acid, 2-Formylfuran-5-boronic acid, 512346_ALDRICH, SBB004171, CID2734355, F3420G1, TL8007120, AI-372/25005759

Molecular Formula:	C₅H₅BO₄	Molecular Weight:	139.901800 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: JUWYQISLQJRRNT-UHFFFAOYSA-N

• 6,7-Dihydro-6-mercapto-5H-pyrazolo[1,2-a][1,2,4]triazolium chloride

IUPAC Name: 6,7-dihydro-5H-pyrazolo[1,2-a][1,2,4]triazol-4-ium-6-thiol;chloride | CAS Registry Number: 153851-71-9
Synonyms: 6,7-Dihydro-6-mercapto-5h-pyrazolo[1,2-a][1,2,4]triazol-4-ium chloride, 5H-Pyrazolo[1,2-a][1,2,4]triazol-4-ium, 6,7-dihydro-6-mercapto-, chloride, Side chain for biapenem, MolPort-003-986-473, ANW-73895, SBB066376, AKOS006284722, AC-2026, RP17817, AK-47895, L840, TL8001153, M-2663, I09-0251, 6,7-dihydro-6-mercapto-5H-pyrazolo[1,2-a][1,2,4]triazolium chloride; 6,7-dihydro-6-mercapto-5H-pyrazolo[1,2-a][1,2,4]triazol-4-ium,c hloride

Molecular Formula:	C₅H₈ClN₃S	Molecular Weight:	177.655120 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: HPBXUFOSZBCEIQ-UHFFFAOYSA-N

• 6-Fluoro-3-(4-piperidinyl)-1,2-benzisoxazole

IUPAC Name: 6-fluoro-3-piperidin-4-yl-1,2-benzoxazole;hydrochloride | CAS Registry Number: 84163-13-3
Synonyms: 6-Fluoro-3-(4-piperidinyl)-1,2-benzisoxazole hydrochloride, 6-Fluoro-3-piperid-4-yl-1,2-benzisoxazole HCl, 6-Fluoro-3-(4-piperidinyl)-1,2-benzisoxazole HCl, 6-Fluoro-3-(4-piperidyl)-1,2-benzisoxazole hydrochloride, 4-(6-Fluoro-1,2-benzisoxazol-3-yl)piperidine hydrochloride, 6-Fluoro-3-(4-piperidinyl)-1,2-benzisoxazolehydrochloride, 6-fluoro-3-(piperidin-4-yl)-1,2-benzoxazole hydrochloride, 6-fluoro-3-(piperidin-4-yl)benzo[d]isoxazole hydrochloride, 6-Fluoro-3-piperidin-4-yl-1,2-benzisoxazole hydrochloride, R-56109 hydrochloride, SureCN531052, UNII-X3U18DS1Y7, AGN-PC-0070EP, CTK3J8204, MolPort-000-847-414, BB_SC-4607, ACN-S003860, ACT02050, ANW-50685, RW2416

Molecular Formula:	C₁₂H₁₄ClFN₂O	Molecular Weight:	256.703763 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: CWPSRUREOSBKBQ-UHFFFAOYSA-N

• 6s-5,6-Dihydro-6-Methyl-4h-Thieno[2,3-B]-Thiopyran-4-One

IUPAC Name: 6-methyl-5,6-dihydrothieno[2,3-b]thiopyran-4-one | CAS Registry Number: 147086-79-1
Synonyms: 120279-85-8, 6-Methyl-5,6-dihydro-thieno[2,3-b]thiopyran-4-one, ACMC-20n52e, SureCN3349385, 4H-Thieno[2,3-b]thiopyran-4-one,5,6-dihydro-6-methyl-, (6S)-, AKOS006286730, AM84430, AK-56354, KB-196305, A808598, 6-methyl-5,6-dihydrothieno[2,3-b]thiopyran-4-one, I14-11420, 5,6-dihydro-6-methyl-4h-thieno[2,3-b]thiopyran-4-one, 6-Methyl-5,6-dihydro-4H-thieno[2,3-b]thiopyran-4-one, 4H-Thieno[2,3-b]thiopyran-4-one,5,6-dihydro-6-methyl-, (6S)

Molecular Formula:	C₈H₈OS₂	Molecular Weight:	184.278520 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: FLJFMDYYNMNASJ-UHFFFAOYSA-N

• 5-[4-({3-chloro-4-[(3-fluorobenzyl)oxy] phenyl} amino)quinazolin-6-yl]-2-furaldehyde

IUPAC Name: 5-[4-[3-chloro-4-[(3-fluorophenyl)methoxy]anilino]quinazolin-6-yl]furan-2-carbaldehyde | CAS Registry Number: 231278-84-5
Synonyms: 5-[4-((3-Chloro-4-((3-fluorobenzyl)oxy)phenyl)amino)quinazolin-6-yl]-2-furaldehyde, 5-(4-((3-Chloro-4-((3-fluorobenzyl)oxy)phenyl)amino)quinazolin-6-yl)furan-2-carbaldehyde, 5-(4-((3-chloro-4-((3-fluorobenzyl)oxy)phenyl)amino)quinazolin-6-yl)-2-furaldehyde, PubChem19908, AGN-PC-0D1ZTN, CTK1A1282, ANW-45786, ZINC22054569, AKOS015888618, AG-E-67174, AK-87981, AB1004633, KB-196476, AM20090639, FT-0659647, ST51051586, W4695, A816574, I01-1249, [5-[4-[4-[(3-Fluorobenzyl)oxy]-3-chloroanilino]-6-quinazolinyl]-2-furancarboxaldehyde

Molecular Formula:	C₂₆H₁₇ClFN₃O₃	Molecular Weight:	473.882883 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	7

InChIKey: XQPZOUAAXRXPAM-UHFFFAOYSA-N

• (S)-1-tert-butyl 2-ethyl 2,3-dihydro-1H-pyrrole-1,2-dicarboxylate

IUPAC Name: 1-O-tert-butyl 2-O-ethyl (2S)-2,3-dihydropyrrole-1,2-dicarboxylate | CAS Registry Number: 178172-26-4
Synonyms: ETHYL N-BOC-L-PROLINE-4-ENE, (S)-1-tert-Butyl 2-ethyl 2,3-dihydro-1H-pyrrole-1,2-dicarboxylate, (S)-1-Boc-2,3-dihydro-2-pyrrolecarboxylic acid ethyl ester, SureCN1571674, PYR230, CTK8E8027, AKOS015909619, AK126851, AB1008499, KB-210788, B80126, I14-32316, (S)-2,3-Dihydro-pyrrole-1,2-dicarboxylic acid 1-tert-butyl ester 2-ethyl ester, 1H-Pyrrole-1,2-dicarboxylic acid, 2,3-dihydro-, 1-(1,1-dimethylethyl) 2-ethyl ester, (2S)-

Molecular Formula:	C₁₂H₁₉NO₄	Molecular Weight:	241.283560 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	4

InChIKey: AZVLZXHTXUIWRZ-VIFPVBQESA-N

• 4,5,6,7-Tetrahydro-1-(4-methoxyphenyl)-6-(4-nitrophenyl)-7-oxo-1H-pyrazolo[3,4-c]pyridine-3-carboxyl

IUPAC Name: ethyl 1-(4-methoxyphenyl)-6-(4-nitrophenyl)-7-oxo-4,5-dihydropyrazolo[3,4-c]pyridine-3-carboxylate | CAS Registry Number: 536759-91-8
Synonyms: Ethyl 1-(4-methoxyphenyl)-6-(4-nitrophenyl)-7-oxo-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-c]pyridine-3-carboxylate, 4,5,6,7-TETRAHYDRO-1-(4-METHOXYPHENYL)-6-(4-NITROPHENYL)-7-OXO-1H-PYRAZOLO[3,4-C]PYRIDINE-3-CARBOXYLIC ACID ETHYL ESTER, AGN-PC-00EMD2, SureCN8243908, CTK8B9854, ANW-63318, AKOS016003678, RL03989, AK-84868, KB-76922, 1-(4-METHOXY-PHENYL)-6-(4-NITRO-PHENYL)-7-OXO-4,5,6,7-TETRAHYDRO-1H-PYRAZOLO[3,4-C]PYRIDINE-3-CARBOXYLIC ACID ETHYL ESTER, 1H-PYRAZOLO[3,4-C]PYRIDINE-3-CARBOXYLIC ACID, 4,5,6,7-TETRAHYDRO-1-(4-METHOXYPHENYL)-6-(4-NITROPHENYL)-7-OXO-, ETHYL ESTER, 4,5,6,7-Tetrahydro-1-(4-methoxyphenyl)-6-(4-nitrophenyl)-7-oxo-1H-pyrazolo[3,4-c]pyridine-3-carboxylic acid ethyl ester, ethyl 1-(4-methoxyphenyl)-6-(4-nitrophenyl)-7-oxo-4,5-dihydropyrazolo[3,4-c]pyridine-3-carboxylate

Molecular Formula:	C₂₂H₂₀N₄O₆	Molecular Weight:	436.417400 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	7

InChIKey: RQNAOIQEGPVYTC-UHFFFAOYSA-N

• 2(1H)-pyridine,3-chloro-5,6-dihydro-1-(4-nitrophenyl)

IUPAC Name: 5-chloro-1-(4-nitrophenyl)-2,3-dihydropyridin-6-one | CAS Registry Number: 536760-29-9
Synonyms: 3-Chloro-1-(4-nitrophenyl)-5,6-dihydropyridin-2(1H)-one, 3-CHLORO-5,6-DIHYDRO-1-(4-NITROPHENYL)-2(1H)-PYRIDINONE, SureCN8243895, AGN-PC-00E57D, CTK8B4270, MolPort-021-783-247, ANW-44563, AKOS015951085, QC-7558, AK-89864, BD227742, KB-70605, AB1008474, X6168, 2(1H)-Pyridinone, 3-chloro-5,6-dihydro-1-(4-nitrophenyl)-

Molecular Formula:	C₁₁H₉ClN₂O₃	Molecular Weight:	252.653760 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: DOUAPYNOGMHPFD-UHFFFAOYSA-N

• 5,6-Dihydro-3-(4-morpholinyl)-1-[4-(2-oxo-1-piperidinyl)phenyl]-2(1H)-pyridinone

IUPAC Name: 5-morpholin-4-yl-1-[4-(2-oxopiperidin-1-yl)phenyl]-2,3-dihydropyridin-6-one | CAS Registry Number: 545445-44-1
Synonyms: 3-Morpholino-1-(4-(2-oxopiperidin-1-yl)phenyl)-5,6-dihydropyridin-2(1H)-one, SureCN5444324, CTK8B4505, ANW-45353, AKOS015998979, QC-2697, AK-87441, KB-236691, AM20090740, FT-0686945, W6875, 2(1H)-Pyridinone, 5,6-dihydro-3-(4-morpholinyl)-1-[4-(2-oxo-1-piperidinyl)phenyl]-, 3-Morpholin-4-yl-1-[4-(2-oxopiperidin-1-yl)phenyl]-5,6-dihydro-1H-pyridin-2-one

Molecular Formula:	C₂₀H₂₅N₃O₃	Molecular Weight:	355.430800 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	4

InChIKey: SCVWQFDPLBFZAP-UHFFFAOYSA-N

• 3-morpholino-1-(4-nitrophenyl)-5,6-dihydropyridin-2(1H)-one

IUPAC Name: 5-morpholin-4-yl-1-(4-nitrophenyl)-2,3-dihydropyridin-6-one | CAS Registry Number: 503615-03-0
Synonyms: 3-Morpholino-1-(4-nitrophenyl)-5,6-dihydropyridin-2(1H)-one, 3-(4-Morpholinyl)-1-(4-nitrophenyl)-5,6-dihydro-2(1H)-pyridinone, 5,6-DIHYDRO-3-(4-MORPHOLINYL)-1-(4-NITROPHENYL)-2(1H)-PYRIDINONE, SureCN1995413, CTK8C1232, MolPort-021-783-245, ANW-66091, AKOS015951080, AK-84866, AB1008472, KB-236692, X5910, 3-MORPHOLIN-4-YL-1-(4-NITRO-PHENYL)-5,6-DIHYDRO-1H-PYRIDIN-2-ONE

Molecular Formula:	C₁₅H₁₇N₃O₄	Molecular Weight:	303.313180 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	5

InChIKey: LBFAEOWNWSDWRZ-UHFFFAOYSA-N

• 2H-Thieno[3,2-e]-1,2-thiazine-6-sulfonamide, 3,4-dihydro-4-hydroxy-2-(3-methoxypropyl)-, 1,1-dioxide, (S)-

IUPAC Name: (4S)-4-hydroxy-2-(3-methoxypropyl)-1,1-dioxo-3,4-dihydrothieno[3,2-e]thiazine-6-sulfonamide | CAS Registry Number: 154127-42-1
Synonyms: AG-E-01977, (4S)-1,1-dioxide-3,4-dihydro-4-hydroxy-2-, (S)-4-Hydroxy-2-(3-methoxypropyl)-3,4-dihydro-2H-thieno[3,2-e][1,2]thiazine-6-sulfonamide 1,1-dioxide, (S)-3,4-Dihydro-4-hydroxy-2-(3-methoxypropyl)-2H-thieno[3,2-e]-1,2-thiazine-6-sulfonamide 1,1-dioxide, (S)-3,4-Dihydro-4-hydroxy-2-(3-methoxypropyl)-2h-thieno(3,2-e)-1,2-thiazine-6-sulfonamide 1,1-dioxide, SureCN2631258, CTK4C8122, MolPort-005-940-986, (S)-3,4-Dihydro-4-hydroxy-2-(3-methoxypropyl)-4H-thieno[3,2-e]-1,2-thiazine-6-sulfonamide 1,1-dioxide, ANW-44505, ZINC22002682, AKOS015897318, RL01975, (S)-4-Hydroxy-2-(3-methoxy-propyl)-, AK-93442, KB-80460, FT-0652537, ST51053549, X0075, I09-0606

Molecular Formula:	C₁₀H₁₆N₂O₆S₃	Molecular Weight:	356.438840 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	9

InChIKey: UHIWBQIWXWWDKT-MRVPVSSYSA-N

• 4-Quinazolinamine, N-[3-chloro-4-[(3-fluorophenyl)methoxy]phenyl]-6-iodo-

IUPAC Name: N-[3-chloro-4-[(3-fluorophenyl)methoxy]phenyl]-6-iodoquinazolin-4-amine | CAS Registry Number: 231278-20-9
Synonyms: AG-E-67171, N-[3-Chloro-4-(3-fluorobenzyloxy)phenyl]-6-iodoquinazolin-4-amine, N-(3-Chloro-4-((3-fluorobenzyl)oxy)phenyl)-6-iodoquinazolin-4-amine, n-(3-chloro-4-(3-fluorobenzyloxy)phenyl)-6-iodoquinazolin-4-amine, N-[3-CHLORO-4-[(3-FLUOROBENZYL)OXY]PHENYL]-6-IODOQUINAZOLIN-4-AMINE, N-[3-chloro-4-[(3-fluorophenyl)methoxy]phenyl]-6-iodo-4-quinazolinamine, N-[3-Chloro-4-(3-Fluorobenzyloxy)-Phenyl]-6-Iodoquinazolin-4-Amine, PubChem19909, AGN-PC-0D1ZTX, SureCN141514, CTK1A1537, ANW-46636, ZINC22054565, AKOS015848952, QC-1121, AK-54559, AB1004632, AM20090640, FT-0658071, ST51051585

Molecular Formula:	C₂₁H₁₄ClFIN₃O	Molecular Weight:	505.711233 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	5

InChIKey: UHFPFDMMKYQMLC-UHFFFAOYSA-N

• (S)-3,4-Dihydro-6-Chloro-4-Hydroxy-2H-Thieno[3,2-E]-1,2-Thiazine-1,1-Dioxide

IUPAC Name: (4S)-6-chloro-1,1-dioxo-3,4-dihydro-2H-thieno[3,2-e]thiazin-4-ol | CAS Registry Number: 160982-16-1
Synonyms: (S)-6-Chloro-4-hydroxy-3,4-dihydro-2H-thieno[3,2-e][1,2]thiazine 1,1-dioxide, (S)-3,4-Dihydro-6-chloro-4-hydroxy-2h-thieno(3,2-e)-1,2-thiazine-1,1-dioxide, (S)-3,4-Dihydro-6-chloro-4-hydroxy-2H-thieno[3,2-e]-1,2-thiazine-1,1-dioxide, SureCN3041948, CTK4D0684, MolPort-005-940-984, ANW-44645, SBB066452, ZINC22002671, AKOS015897319, AG-E-10616, AK-60184, KB-211620, FT-0659709, X0076, I09-0607, (S)-6-Chloro-1,1-dioxo-1,2,3,4-tetrahydro-1lambda*6*-thieno[3,2-e][1,2]thiazin-4-ol, 2H-Thieno[3,2-e]-1,2-thiazin-4-ol,6-chloro-3,4-dihydro-, 1,1-dioxide, (4S)-, 2H-Thieno[3,2-e]-1,2-thiazin-4-ol,6-chloro-3,4-dihydro-, 1,1-dioxide, (S)-;(4S)-6-Chloro-3,4-dihydro-2H-thieno[3,2-e][1,2]thiazin-4-ol 1,1-dioxide;

Molecular Formula:	C₆H₆ClNO₃S₂	Molecular Weight:	239.699740 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	5

InChIKey: OFJGKGNJDCLNPM-SCSAIBSYSA-N

• (S)-6-Chloro-2-(3-Methoxypropyl)-3,4-Dihydro-2H-Thieno[3,2-E][1,2]thiazin-4-Ol 1,1-Dioxide

IUPAC Name: (4S)-6-chloro-2-(3-methoxypropyl)-1,1-dioxo-3,4-dihydrothieno[3,2-e]thiazin-4-ol | CAS Registry Number: 160982-13-8
Synonyms: (S)-6-Chloro-4-hydroxy-2-(3-methoxypropyl)-3,4-dihydro-2H-thieno[3,2-e][1,2]thiazine 1,1-dioxide, SureCN2726839, CTK4D0683, MolPort-005-940-985, ANW-64651, ZINC22002675, AG-E-10615, (S)-6-Chloro-2-(3-methoxy-propyl)-1, AK103600, KB-211619, (4S)-6-Chloro-3,4-dihydro-2-(3-methoxypropyl)-2H-thieno[3,2-e]-1,2-thiazin-4-ol 1,1-Dioxide, (S)-6-Chloro-3,4-dihydro-2-(3-methoxypropyl)-2H-thieno[3,2-e]-1,2-thiazin-4-ol 1,1-Dioxide, 2H-Thieno[3,2-e]-1,2-thiazin-4-ol,6-chloro-3,4-dihydro-2-(3-methoxypropyl)-, 1,1-dioxide, (4S)-, 2H-Thieno[3,2-e]-1,2-thiazin-4-ol,6-chloro-3,4-dihydro-2-(3-methoxypropyl)-, 1,1-dioxide, (S)-;

Molecular Formula:	C₁₀H₁₄ClNO₄S₂	Molecular Weight:	311.805460 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	6

InChIKey: FMNGDEKOOMHKNT-MRVPVSSYSA-N