Vitas-M small molecule compound
2-{[3-cyano-4-(2-fluorophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}-N-(4-methylphenyl)acetamide
Catalog ID
STK546374
SMILES N#CC1=C(SCC(=O)Nc2ccc(cc2)C)NC2=C(C1c1ccccc1F)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 C25H22FN3O2S MW 447.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22FN3O2S/c1-15-9-11-16(12-10-15)28-22(31)14-32-25-18(13-27)23(17-5-2-3-6-19(17)26)24-20(29-25)7-4-8-21(24)30/h2-3,5-6,9-12,23,29H,4,7-8,14H2,1H3,(H,28,31)InChIKey
SFEIFTPLIHIRNF-UHFFFAOYSA-NSynonyms
797764-60-42((3cyano4(2fluorophenyl)5oxo145678hexahydroquinolin2yl)sulfanyl)N(4methylphenyl)acetamide
2((3cyano4(2fluorophenyl)5oxo145678hexahydroquinolin2yl)thio)N(ptolyl)acetamide
2((3cyano4(2fluorophenyl)5oxo4678tetrahydro1Hquinolin2yl)sulfanyl)N(4methylphenyl)acetamide
797764604
CC1=CC=C(C=C1)NC(=O)CSC2=C(C(C3=C(N2)CCCC3=O)C4=CC=CC=C4F)C#N
InChI=1SC25H22FN3O2Sc11591116(121015)2822(31)14322518(1327)23(17523619(17)26)2420(2925)74821(24)30h23569122329H47814H21H3(H2831)
MFCD03664304
ZINC000013174651
ZINC000013174653
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