Vitas-M small molecule compound
N-[4-chloro-3-(trifluoromethyl)phenyl]-2-{[3-cyano-4-(2-fluorophenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}acetamide
Catalog ID
STK827596
SMILES N#CC1=C(SCC(=O)Nc2ccc(c(c2)C(F)(F)F)Cl)NC(=O)CC1c1ccccc1F
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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 C21H14ClF4N3O2S MW 483.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14ClF4N3O2S/c22-16-6-5-11(7-15(16)21(24,25)26)28-19(31)10-32-20-14(9-27)13(8-18(30)29-20)12-3-1-2-4-17(12)23/h1-7,13H,8,10H2,(H,28,31)(H,29,30)InChIKey
GVVCFNBIMARTGH-UHFFFAOYSA-NSynonyms
C1C(C(=C(NC1=O)SCC(=O)NC2=CC(=C(C=C2)Cl)C(F)(F)F)C#N)C3=CC=CC=C3F
InChI=1SC21H14ClF4N3O2Sc22166511(715(16)21(2425)26)2819(31)10322014(927)13(818(30)2920)12312417(12)23h1713H810H2(H2831)(H2930)
MFCD10088115
N(4chloro3(trifluoromethyl)phenyl)2((3cyano4(2fluorophenyl)6oxo1456tetrahydropyridin2yl)sulfanyl)acetamide
N(4chloro3(trifluoromethyl)phenyl)2((5cyano4(2fluorophenyl)2oxo34dihydro1Hpyridin6yl)sulfanyl)acetamide
ZINC000012276865
ZINC000012276866
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