Vitas-M small molecule compound

propan-2-yl 2,6-dimethyl-5-[(phenylsulfonyl)amino]-1-benzofuran-3-carboxylate

Catalog ID
STK230025
SMILES CC(OC(=O)c1c(C)oc2c1cc(NS(=O)(=O)c1ccccc1)c(c2)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/c1-12(2)25-20(22)19-14(4)26-18-10-13(3)17(11-16(18)19)21-27(23,24)15-8-6-5-7-9-15/h5-12,21H,1-4H3
InChIKey
XMRWLZMFLVFGTD-UHFFFAOYSA-N
Synonyms
848336-10-7
848336107
CC1=C(C=C2C(=C1)OC(=C2C(=O)OC(C)C)C)NS(=O)(=O)C3=CC=CC=C3
InChI=1SC20H21NO5Sc112(2)2520(22)1914(4)26181013(3)17(1116(18)19)2127(2324)158657915h51221H14H3
MFCD07330386
propan2yl26dimethyl5((phenylsulfonyl)amino)1benzofuran3carboxylate
PROPAN2YL5(BENZENESULFONAMIDO)26DIMETHYL1BENZOFURAN3CARBOXYLATE
ZINC000004735808
ZINC04735808
ZINC4735808

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Available files

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