Vitas-M small molecule compound
ethyl 5-(acetyloxy)-6-bromo-2-{[(3-cyano-6-methylpyridin-2-yl)sulfanyl]methyl}-1-methyl-1H-indole-3-carboxylate
Catalog ID
STK700020
SMILES CCOC(=O)c1c2cc(OC(=O)C)c(cc2n(c1CSc1nc(C)ccc1C#N)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 C22H20BrN3O4S MW 502.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20BrN3O4S/c1-5-29-22(28)20-15-8-19(30-13(3)27)16(23)9-17(15)26(4)18(20)11-31-21-14(10-24)7-6-12(2)25-21/h6-9H,5,11H2,1-4H3InChIKey
JKKTYFSOYYVOEH-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(N(C2=CC(=C(C=C21)OC(=O)C)Br)C)CSC3=C(C=CC(=N3)C)C#N
ETHYL5(ACETYLOXY)6BROMO2(((3CYANO6METHYL2PYRIDINYL)SULFANYL)METHYL)1METHYL1HINDOLE3CARBOXYLATE
ethyl5(acetyloxy)6bromo2(((3cyano6methylpyridin2yl)sulfanyl)methyl)1methyl1Hindole3carboxylate
ETHYL5ACETYLOXY6BROMO2((3CYANO6METHYLPYRIDIN2YL)SULFANYLMETHYL)1METHYLINDOLE3CARBOXYLATE
InChI=1SC22H20BrN3O4Sc152922(28)2015819(3013(3)27)16(23)917(15)26(4)18(20)11312114(1024)7612(2)2521h69H511H214H3
MFCD01121918
ZINC000000792906
ZINC00792906
ZINC792906
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