Vitas-M small molecule compound
N-(4-bromophenyl)-2-{[3,5-dicyano-6-hydroxy-4-(2-methoxyphenyl)-4,5-dihydropyridin-2-yl]sulfanyl}acetamide
Catalog ID
STK631586
SMILES N#CC1C(=NC(=C(C1c1ccccc1OC)C#N)SCC(=O)Nc1ccc(cc1)Br)O
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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 C22H17BrN4O3S MW 497.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17BrN4O3S/c1-30-18-5-3-2-4-15(18)20-16(10-24)21(29)27-22(17(20)11-25)31-12-19(28)26-14-8-6-13(23)7-9-14/h2-9,16,20H,12H2,1H3,(H,26,28)(H,27,29)InChIKey
ZZELSQUMGNWWJZ-UHFFFAOYSA-NSynonyms
COC1=CC=CC=C1C2C(C(=O)NC(=C2C#N)SCC(=O)NC3=CC=C(C=C3)Br)C#N
InChI=1SC22H17BrN4O3Sc13018532415(18)2016(1024)21(29)2722(17(20)1125)311219(28)26148613(23)7914h291620H12H21H3(H2628)(H2729)
MFCD18159515
N(4BROMOPHENYL)2((35DICYANO4(2METHOXYPHENYL)2OXO34DIHYDRO1HPYRIDIN6YL)SULFANYL)ACETAMIDE
N(4bromophenyl)2((35dicyano6hydroxy4(2methoxyphenyl)45dihydropyridin2yl)sulfanyl)acetamide
ZINC000000875459
ZINC000000875463
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