Vitas-M small molecule compound

ethyl 1,2-dimethyl-5-{[(4-methylphenyl)sulfonyl]oxy}-1H-indole-3-carboxylate

Catalog ID
STK837536
SMILES CCOC(=O)c1c(C)n(c2c1cc(cc2)OS(=O)(=O)c1ccc(cc1)C)C

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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 C20H21NO5S MW 387.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21NO5S/c1-5-25-20(22)19-14(3)21(4)18-11-8-15(12-17(18)19)26-27(23,24)16-9-6-13(2)7-10-16/h6-12H,5H2,1-4H3
InChIKey
FIWHTPKFMBOYBY-UHFFFAOYSA-N
Synonyms
88461-72-7
88461727
CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OS(=O)(=O)C3=CC=C(C=C3)C)C)C
ethyl12dimethyl5(((4methylphenyl)sulfonyl)oxy)1Hindole3carboxylate
ETHYL12DIMETHYL5(4METHYLPHENYL)SULFONYLOXYINDOLE3CARBOXYLATE
ethyl12dimethyl5(tosyloxy)1Hindole3carboxylate
InChI=1SC20H21NO5Sc152520(22)1914(3)21(4)1811815(1217(18)19)2627(2324)169613(2)71016h612H5H214H3
MFCD00552132
ZINC000002075176
ZINC02075176
ZINC2075176

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.