Vitas-M small molecule compound
N-(4-bromophenyl)-2-{[3,5-dicyano-4-(2-ethoxyphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}acetamide
Catalog ID
STK725959
SMILES CCOc1ccccc1C1C(=C(SCC(=O)Nc2ccc(cc2)Br)NC(=O)C1C#N)C#N
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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 C23H19BrN4O3S MW 511.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19BrN4O3S/c1-2-31-19-6-4-3-5-16(19)21-17(11-25)22(30)28-23(18(21)12-26)32-13-20(29)27-15-9-7-14(24)8-10-15/h3-10,17,21H,2,13H2,1H3,(H,27,29)(H,28,30)InChIKey
ORXQUJNFRGTZIG-UHFFFAOYSA-NSynonyms
CCOC1=CC=CC=C1C2C(C(=O)NC(=C2C#N)SCC(=O)NC3=CC=C(C=C3)Br)C#N
InChI=1SC23H19BrN4O3Sc123119643516(19)2117(1125)22(30)2823(18(21)1226)321320(29)27159714(24)81015h3101721H213H21H3(H2729)(H2830)
MFCD02047727
N(4BROMOPHENYL)2((35DICYANO4(2ETHOXYPHENYL)2OXO34DIHYDRO1HPYRIDIN6YL)SULFANYL)ACETAMIDE
N(4bromophenyl)2((35dicyano4(2ethoxyphenyl)6oxo1456tetrahydropyridin2yl)sulfanyl)acetamide
N(4bromophenyl)2((35dicyano4(2ethoxyphenyl)6oxo1456tetrahydropyridin2yl)thio)acetamide
ZINC000009015474
ZINC000017016220
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