Vitas-M small molecule compound

2-{[3-cyano-4-(4-fluorophenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}-N-(4-methoxyphenyl)acetamide

Catalog ID
STK842992
SMILES N#CC1=C(SCC(=O)Nc2ccc(cc2)OC)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 C21H18FN3O3S MW 411.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18FN3O3S/c1-28-16-8-6-15(7-9-16)24-20(27)12-29-21-18(11-23)17(10-19(26)25-21)13-2-4-14(22)5-3-13/h2-9,17H,10,12H2,1H3,(H,24,27)(H,25,26)
InChIKey
HKEKIIKBCNOPSH-UHFFFAOYSA-N
Synonyms
684237-85-2
2((3cyano4(4fluorophenyl)6oxo1456tetrahydropyridin2yl)sulfanyl)N(4methoxyphenyl)acetamide
2((3cyano4(4fluorophenyl)6oxo1456tetrahydropyridin2yl)thio)N(4methoxyphenyl)acetamide
2((5CYANO4(4FLUOROPHENYL)2OXO34DIHYDRO1HPYRIDIN6YL)SULFANYL)N(4METHOXYPHENYL)ACETAMIDE
684237852
COC1=CC=C(C=C1)NC(=O)CSC2=C(C(CC(=O)N2)C3=CC=C(C=C3)F)C#N
InChI=1SC21H18FN3O3Sc128168615(7916)2420(27)12292118(1123)17(1019(26)2521)132414(22)5313h2917H1012H21H3(H2427)(H2526)
MFCD03667651
ZINC000009012526
ZINC000009014575
ZINC00795197

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Available files

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