Vitas-M small molecule compound
2-{[4-(3-bromophenyl)-3-cyano-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}-N-(4-methoxyphenyl)acetamide
Catalog ID
STK841822
SMILES N#CC1=C(SCC(=O)Nc2ccc(cc2)OC)NC(=O)CC1c1cccc(c1)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/c1-28-16-7-5-15(6-8-16)24-20(27)12-29-21-18(11-23)17(10-19(26)25-21)13-3-2-4-14(22)9-13/h2-9,17H,10,12H2,1H3,(H,24,27)(H,25,26)InChIKey
GIQXMVSGAOYCRY-UHFFFAOYSA-NSynonyms
488792-87-62((4(3bromophenyl)3cyano6oxo1456tetrahydropyridin2yl)sulfanyl)N(4methoxyphenyl)acetamide
2((4(3bromophenyl)3cyano6oxo1456tetrahydropyridin2yl)thio)N(4methoxyphenyl)acetamide
2((4(3BROMOPHENYL)5CYANO2OXO34DIHYDRO1HPYRIDIN6YL)SULFANYL)N(4METHOXYPHENYL)ACETAMIDE
488792876
COC1=CC=C(C=C1)NC(=O)CSC2=C(C(CC(=O)N2)C3=CC(=CC=C3)Br)C#N
InChI=1SC21H18BrN3O3Sc128167515(6816)2420(27)12292118(1123)17(1019(26)2521)1332414(22)913h2917H1012H21H3(H2427)(H2526)
MFCD03292546
ZINC000009334828
ZINC000009353571
ZINC09334828
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