Vitas-M small molecule compound
2-{[3-cyano-4-(4-fluorophenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}-N-[2-(trifluoromethyl)phenyl]acetamide
Catalog ID
STK891716
SMILES N#CC1=C(SCC(=O)Nc2ccccc2C(F)(F)F)NC(=O)CC1c1ccc(cc1)F
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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 C21H15F4N3O2S MW 449.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15F4N3O2S/c22-13-7-5-12(6-8-13)14-9-18(29)28-20(15(14)10-26)31-11-19(30)27-17-4-2-1-3-16(17)21(23,24)25/h1-8,14H,9,11H2,(H,27,30)(H,28,29)InChIKey
MEEJUKUADHOEQI-UHFFFAOYSA-NSynonyms
2((3cyano4(4fluorophenyl)6oxo1456tetrahydropyridin2yl)sulfanyl)N(2(trifluoromethyl)phenyl)acetamide
2((5cyano4(4fluorophenyl)2oxo34dihydro1Hpyridin6yl)sulfanyl)N(2(trifluoromethyl)phenyl)acetamide
C1C(C(=C(NC1=O)SCC(=O)NC2=CC=CC=C2C(F)(F)F)C#N)C3=CC=C(C=C3)F
InChI=1SC21H15F4N3O2Sc22137512(6813)14918(29)2820(15(14)1026)311119(30)2717421316(17)21(2324)25h1814H911H2(H2730)(H2829)
MFCD04400863
ZINC000012276760
ZINC000012276762
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