Vitas-M small molecule compound
ethyl 5-(acetyloxy)-6-bromo-2-{[(4-chlorophenyl)sulfonyl]methyl}-1-methyl-1H-indole-3-carboxylate
Catalog ID
STK683164
SMILES CCOC(=O)c1c2cc(OC(=O)C)c(cc2n(c1CS(=O)(=O)c1ccc(cc1)Cl)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 C21H19BrClNO6S MW 528.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19BrClNO6S/c1-4-29-21(26)20-15-9-19(30-12(2)25)16(22)10-17(15)24(3)18(20)11-31(27,28)14-7-5-13(23)6-8-14/h5-10H,4,11H2,1-3H3InChIKey
FWNILESDUMAYOY-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(N(C2=CC(=C(C=C21)OC(=O)C)Br)C)CS(=O)(=O)C3=CC=C(C=C3)Cl
ethyl5(acetyloxy)6bromo2(((4chlorophenyl)sulfonyl)methyl)1methyl1Hindole3carboxylate
ETHYL5ACETYLOXY6BROMO2((4CHLOROPHENYL)SULFONYLMETHYL)1METHYLINDOLE3CARBOXYLATE
InChI=1SC21H19BrClNO6Sc142921(26)2015919(3012(2)25)16(22)1017(15)24(3)18(20)1131(2728)147513(23)6814h510H411H213H3
MFCD05256943
ZINC000001421881
ZINC1421881
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