Vitas-M small molecule compound
2-({4-[4-(benzyloxy)phenyl]-3-cyano-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl}sulfanyl)-N-(2-methylphenyl)acetamide
Catalog ID
STK538219
SMILES N#CC1=C(SCC(=O)Nc2ccccc2C)NC2=C(C1c1ccc(cc1)OCc1ccccc1)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 C32H29N3O3S MW 535.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H29N3O3S/c1-21-8-5-6-11-26(21)34-29(37)20-39-32-25(18-33)30(31-27(35-32)12-7-13-28(31)36)23-14-16-24(17-15-23)38-19-22-9-3-2-4-10-22/h2-6,8-11,14-17,30,35H,7,12-13,19-20H2,1H3,(H,34,37)InChIKey
FXCFWGJXPOZGHN-UHFFFAOYSA-NSynonyms
383896-56-82((3cyano5oxo4(4phenylmethoxyphenyl)4678tetrahydro1Hquinolin2yl)sulfanyl)N(2methylphenyl)acetamide
2((4(4(benzyloxy)phenyl)3cyano5oxo145678hexahydroquinolin2yl)sulfanyl)N(2methylphenyl)acetamide
2((4(4(benzyloxy)phenyl)3cyano5oxo145678hexahydroquinolin2yl)thio)N(otolyl)acetamide
383896568
CC1=CC=CC=C1NC(=O)CSC2=C(C(C3=C(N2)CCCC3=O)C4=CC=C(C=C4)OCC5=CC=CC=C5)C#N
InChI=1SC32H29N3O3Sc1218561126(21)3429(37)20393225(1833)30(3127(3532)1271328(31)36)23141624(171523)38192293241022h2681114173035H712131920H21H3(H3437)
MFCD03000794
ZINC000002312319
ZINC000002312320
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