Vitas-M small molecule compound
2-{[3-cyano-4-(2,3-dichlorophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}-N-(3-methylphenyl)acetamide
Catalog ID
STK543112
SMILES N#CC1=C(SCC(=O)Nc2cccc(c2)C)NC2=C(C1c1cccc(c1Cl)Cl)C(=O)CCC2
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C25H21Cl2N3O2S MW 498.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21Cl2N3O2S/c1-14-5-2-6-15(11-14)29-21(32)13-33-25-17(12-28)22(16-7-3-8-18(26)24(16)27)23-19(30-25)9-4-10-20(23)31/h2-3,5-8,11,22,30H,4,9-10,13H2,1H3,(H,29,32)InChIKey
FXWMPFYHBBPIPA-UHFFFAOYSA-NSynonyms
498571-14-52((3cyano4(23dichlorophenyl)5oxo145678hexahydroquinolin2yl)sulfanyl)N(3methylphenyl)acetamide
2((3cyano4(23dichlorophenyl)5oxo145678hexahydroquinolin2yl)thio)N(mtolyl)acetamide
2((3cyano4(23dichlorophenyl)5oxo4678tetrahydro1Hquinolin2yl)sulfanyl)N(3methylphenyl)acetamide
498571145
CC1=CC(=CC=C1)NC(=O)CSC2=C(C(C3=C(N2)CCCC3=O)C4=C(C(=CC=C4)Cl)Cl)C#N
InChI=1SC25H21Cl2N3O2Sc11452615(1114)2921(32)13332517(1228)22(1673818(26)24(16)27)2319(3025)941020(23)31h2358112230H491013H21H3(H2932)
MFCD03302217
ZINC000013174837
ZINC000013174838
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