Vitas-M small molecule compound

ethyl 6-methyl-5-{[(4-methylphenyl)sulfonyl]amino}-2-propyl-1-benzofuran-3-carboxylate

Catalog ID
STK230044
SMILES CCOC(=O)c1c(CCC)oc2c1cc(NS(=O)(=O)c1ccc(cc1)C)c(c2)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 C22H25NO5S MW 415.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25NO5S/c1-5-7-19-21(22(24)27-6-2)17-13-18(15(4)12-20(17)28-19)23-29(25,26)16-10-8-14(3)9-11-16/h8-13,23H,5-7H2,1-4H3
InChIKey
PAKRERVAHAMZGS-UHFFFAOYSA-N
Synonyms
848335-48-8
848335488
CCCC1=C(C2=CC(=C(C=C2O1)C)NS(=O)(=O)C3=CC=C(C=C3)C)C(=O)OCC
ethyl6methyl5(((4methylphenyl)sulfonyl)amino)2propyl1benzofuran3carboxylate
ETHYL6METHYL5((4METHYLPHENYL)SULFONYLAMINO)2PROPYL1BENZOFURAN3CARBOXYLATE
InChI=1SC22H25NO5Sc1571921(22(24)2762)171318(15(4)1220(17)2819)2329(2526)1610814(3)91116h81323H57H214H3
MFCD07330102
ZINC000004735825
ZINC04735825
ZINC4735825

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Available files

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