Vitas-M small molecule compound
N-(4-bromophenyl)-2-{[3-cyano-4-(3-methoxyphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}acetamide
Catalog ID
STK860577
SMILES COc1cccc(c1)C1CC(=O)NC(=C1C#N)SCC(=O)Nc1ccc(cc1)Br
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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 C21H18BrN3O3S MW 472.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18BrN3O3S/c1-28-16-4-2-3-13(9-16)17-10-19(26)25-21(18(17)11-23)29-12-20(27)24-15-7-5-14(22)6-8-15/h2-9,17H,10,12H2,1H3,(H,24,27)(H,25,26)InChIKey
BXUMSODEFRGRHF-UHFFFAOYSA-NSynonyms
332051-32-8332051328
COC1=CC=CC(=C1)C2CC(=O)NC(=C2C#N)SCC(=O)NC3=CC=C(C=C3)Br
InChI=1SC21H18BrN3O3Sc1281642313(916)171019(26)2521(18(17)1123)291220(27)24157514(22)6815h2917H1012H21H3(H2427)(H2526)
MFCD01455048
N(4bromophenyl)2((3cyano4(3methoxyphenyl)6oxo1456tetrahydropyridin2yl)sulfanyl)acetamide
N(4bromophenyl)2((3cyano4(3methoxyphenyl)6oxo1456tetrahydropyridin2yl)thio)acetamide
N(4BROMOPHENYL)2((5CYANO4(3METHOXYPHENYL)2OXO34DIHYDRO1HPYRIDIN6YL)SULFANYL)ACETAMIDE
ZINC000009087643
ZINC000009088744
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