Vitas-M small molecule compound
ethyl 6-bromo-2-{[(4-ethylphenyl)sulfanyl]methyl}-5-hydroxy-1-methyl-1H-indole-3-carboxylate
Catalog ID
STL297534
SMILES CCOC(=O)c1c2cc(O)c(cc2n(c1CSc1ccc(cc1)CC)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 C21H22BrNO3S MW 448.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22BrNO3S/c1-4-13-6-8-14(9-7-13)27-12-18-20(21(25)26-5-2)15-10-19(24)16(22)11-17(15)23(18)3/h6-11,24H,4-5,12H2,1-3H3InChIKey
FWQRZWCSRYHELS-UHFFFAOYSA-NSynonyms
172421-76-0172421760
CCC1=CC=C(C=C1)SCC2=C(C3=CC(=C(C=C3N2C)Br)O)C(=O)OCC
ethyl6bromo2(((4ethylphenyl)sulfanyl)methyl)5hydroxy1methyl1Hindole3carboxylate
ethyl6bromo2(((4ethylphenyl)thio)methyl)5hydroxy1methyl1Hindole3carboxylate
ETHYL6BROMO2((4ETHYLPHENYL)SULFANYLMETHYL)5HYDROXY1METHYLINDOLE3CARBOXYLATE
InChI=1SC21H22BrNO3Sc14136814(9713)27121820(21(25)2652)151019(24)16(22)1117(15)23(18)3h61124H4512H213H3
MFCD01558699
ZINC000008951203
ZINC08951203
ZINC8951203
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