Vitas-M small molecule compound
N-(4-bromophenyl)-2-{[3-cyano-4-(3,4-dimethoxyphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}acetamide
Catalog ID
STK838703
SMILES N#CC1=C(SCC(=O)Nc2ccc(cc2)Br)NC(=O)CC1c1ccc(c(c1)OC)OC
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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 C22H20BrN3O4S MW 502.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20BrN3O4S/c1-29-18-8-3-13(9-19(18)30-2)16-10-20(27)26-22(17(16)11-24)31-12-21(28)25-15-6-4-14(23)5-7-15/h3-9,16H,10,12H2,1-2H3,(H,25,28)(H,26,27)InChIKey
KIBRGLOSZOJLRX-UHFFFAOYSA-NSynonyms
COC1=C(C=C(C=C1)C2CC(=O)NC(=C2C#N)SCC(=O)NC3=CC=C(C=C3)Br)OC
InChI=1SC22H20BrN3O4Sc129188313(919(18)302)161020(27)2622(17(16)1124)311221(28)25156414(23)5715h3916H1012H212H3(H2528)(H2627)
MFCD01579020
N(4bromophenyl)2((3cyano4(34dimethoxyphenyl)6oxo1456tetrahydropyridin2yl)sulfanyl)acetamide
N(4bromophenyl)2((3cyano4(34dimethoxyphenyl)6oxo1456tetrahydropyridin2yl)thio)acetamide
N(4BROMOPHENYL)2((5CYANO4(34DIMETHOXYPHENYL)2OXO34DIHYDRO1HPYRIDIN6YL)SULFANYL)ACETAMIDE
ZINC000009087871
ZINC000009087872
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