Vitas-M small molecule compound
2-{[3-cyano-4-(2-fluorophenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}-N-(4-methoxyphenyl)acetamide
Catalog ID
STK841669
SMILES N#CC1=C(SCC(=O)Nc2ccc(cc2)OC)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 C21H18FN3O3S MW 411.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18FN3O3S/c1-28-14-8-6-13(7-9-14)24-20(27)12-29-21-17(11-23)16(10-19(26)25-21)15-4-2-3-5-18(15)22/h2-9,16H,10,12H2,1H3,(H,24,27)(H,25,26)InChIKey
PWCQXMFJIKNKCC-UHFFFAOYSA-NSynonyms
489400-78-42((3cyano4(2fluorophenyl)6oxo1456tetrahydropyridin2yl)sulfanyl)N(4methoxyphenyl)acetamide
2((3cyano4(2fluorophenyl)6oxo1456tetrahydropyridin2yl)thio)N(4methoxyphenyl)acetamide
2((5CYANO4(2FLUOROPHENYL)2OXO34DIHYDRO1HPYRIDIN6YL)SULFANYL)N(4METHOXYPHENYL)ACETAMIDE
489400784
COC1=CC=C(C=C1)NC(=O)CSC2=C(C(CC(=O)N2)C3=CC=CC=C3F)C#N
InChI=1SC21H18FN3O3Sc128148613(7914)2420(27)12292117(1123)16(1019(26)2521)15423518(15)22h2916H1012H21H3(H2427)(H2526)
MFCD03295852
ZINC000008968969
ZINC000008968972
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