Vitas-M small molecule compound
ethyl 5-(acetyloxy)-6-bromo-1-methyl-2-[(phenylsulfanyl)methyl]-1H-indole-3-carboxylate
Catalog ID
STK751285
SMILES CCOC(=O)c1c2cc(OC(=O)C)c(cc2n(c1CSc1ccccc1)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 C21H20BrNO4S MW 462.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20BrNO4S/c1-4-26-21(25)20-15-10-19(27-13(2)24)16(22)11-17(15)23(3)18(20)12-28-14-8-6-5-7-9-14/h5-11H,4,12H2,1-3H3InChIKey
PLUCUIPGCPBWEW-UHFFFAOYSA-NSynonyms
141061-97-4141061974
6BROMO3(ETHOXYCARBONYL)1METHYL2(PHENYLTHIOMETHYL)INDOL5YLACETATE
CCOC(=O)C1=C(N(C2=CC(=C(C=C21)OC(=O)C)Br)C)CSC3=CC=CC=C3
ethyl5(acetyloxy)6bromo1methyl2((phenylsulfanyl)methyl)1Hindole3carboxylate
ETHYL5ACETOXY6BROMO1METHYL2(PHENYLTHIOMETHYL)1HINDOLE3CARBOXYLATE
ETHYL5ACETYLOXY6BROMO1METHYL2(PHENYLSULFANYLMETHYL)INDOLE3CARBOXYLATE
InChI=1SC21H20BrNO4Sc142621(25)20151019(2713(2)24)16(22)1117(15)23(3)18(20)1228148657914h511H412H213H3
INDOLE3CARBOXYLICACID5ACETOXY6BROMO1METHYL2PHENYLTHIOMETHYLETHYLESTER
MFCD00357755
ZINC000000653404
ZINC00653404
ZINC653404
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