Vitas-M small molecule compound
2-{[3-cyano-4-(4-fluorophenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}-N-(3-methoxyphenyl)acetamide
Catalog ID
STK843340
SMILES COc1cccc(c1)NC(=O)CSC1=C(C#N)C(CC(=O)N1)c1ccc(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 C21H18FN3O3S MW 411.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18FN3O3S/c1-28-16-4-2-3-15(9-16)24-20(27)12-29-21-18(11-23)17(10-19(26)25-21)13-5-7-14(22)8-6-13/h2-9,17H,10,12H2,1H3,(H,24,27)(H,25,26)InChIKey
ZSFQEMYAPJLOKR-UHFFFAOYSA-NSynonyms
684237-84-12((3cyano4(4fluorophenyl)6oxo1456tetrahydropyridin2yl)sulfanyl)N(3methoxyphenyl)acetamide
2((3cyano4(4fluorophenyl)6oxo1456tetrahydropyridin2yl)thio)N(3methoxyphenyl)acetamide
2((5CYANO4(4FLUOROPHENYL)2OXO34DIHYDRO1HPYRIDIN6YL)SULFANYL)N(3METHOXYPHENYL)ACETAMIDE
684237841
COC1=CC=CC(=C1)NC(=O)CSC2=C(C(CC(=O)N2)C3=CC=C(C=C3)F)C#N
InChI=1SC21H18FN3O3Sc1281642315(916)2420(27)12292118(1123)17(1019(26)2521)135714(22)8613h2917H1012H21H3(H2427)(H2526)
MFCD03663114
ZINC000009015348
ZINC000009015349
ZINC00795192
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