Vitas-M small molecule compound
2-{[3-cyano-4-(4-fluorophenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}-N-[3-(trifluoromethyl)phenyl]acetamide
Catalog ID
STK891722
SMILES N#CC1=C(SCC(=O)Nc2cccc(c2)C(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/c22-14-6-4-12(5-7-14)16-9-18(29)28-20(17(16)10-26)31-11-19(30)27-15-3-1-2-13(8-15)21(23,24)25/h1-8,16H,9,11H2,(H,27,30)(H,28,29)InChIKey
RDRQSYJCUQAVRK-UHFFFAOYSA-NSynonyms
2((3cyano4(4fluorophenyl)6oxo1456tetrahydropyridin2yl)sulfanyl)N(3(trifluoromethyl)phenyl)acetamide
2((5cyano4(4fluorophenyl)2oxo34dihydro1Hpyridin6yl)sulfanyl)N(3(trifluoromethyl)phenyl)acetamide
C1C(C(=C(NC1=O)SCC(=O)NC2=CC=CC(=C2)C(F)(F)F)C#N)C3=CC=C(C=C3)F
InChI=1SC21H15F4N3O2Sc22146412(5714)16918(29)2820(17(16)1026)311119(30)271531213(815)21(2324)25h1816H911H2(H2730)(H2829)
MFCD04385832
ZINC000012276771
ZINC000012276774
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