Vitas-M small molecule compound
ethyl 5-(acetyloxy)-6-bromo-2-{[(3-cyano-4,6-dimethylpyridin-2-yl)sulfanyl]methyl}-1-methyl-1H-indole-3-carboxylate
Catalog ID
STK759030
SMILES CCOC(=O)c1c2cc(OC(=O)C)c(cc2n(c1CSc1nc(C)cc(c1C#N)C)C)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 C23H22BrN3O4S MW 516.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22BrN3O4S/c1-6-30-23(29)21-15-8-20(31-14(4)28)17(24)9-18(15)27(5)19(21)11-32-22-16(10-25)12(2)7-13(3)26-22/h7-9H,6,11H2,1-5H3InChIKey
FEKTXJRLVJYRHH-UHFFFAOYSA-NSynonyms
312500-88-2312500882
5ACETOXY6BROMO2(3CYANO46DIMETHYLPYRIDIN2YLSULFANYLMETHYL)1METHYL1HINDOLE3CARBOXYLICACIDETHYLESTER
CCOC(=O)C1=C(N(C2=CC(=C(C=C21)OC(=O)C)Br)C)CSC3=C(C(=CC(=N3)C)C)C#N
ethyl5(acetyloxy)6bromo2(((3cyano46dimethylpyridin2yl)sulfanyl)methyl)1methyl1Hindole3carboxylate
ethyl5acetoxy6bromo2(((3cyano46dimethylpyridin2yl)thio)methyl)1methyl1Hindole3carboxylate
ETHYL5ACETYLOXY6BROMO2((3CYANO46DIMETHYLPYRIDIN2YL)SULFANYLMETHYL)1METHYLINDOLE3CARBOXYLATE
InChI=1SC23H22BrN3O4Sc163023(29)2115820(3114(4)28)17(24)918(15)27(5)19(21)11322216(1025)12(2)713(3)2622h79H611H215H3
MFCD01121919
ZINC000001061620
ZINC01061620
ZINC1061620
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