Vitas-M small molecule compound

butyl 2-methyl-5-{[(2,4,5-trimethylphenyl)sulfonyl]amino}-1-benzofuran-3-carboxylate

Catalog ID
STK236153
SMILES CCCCOC(=O)c1c(C)oc2c1cc(cc2)NS(=O)(=O)c1cc(C)c(cc1C)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 C23H27NO5S MW 429.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27NO5S/c1-6-7-10-28-23(25)22-17(5)29-20-9-8-18(13-19(20)22)24-30(26,27)21-12-15(3)14(2)11-16(21)4/h8-9,11-13,24H,6-7,10H2,1-5H3
InChIKey
QBZXOORWORWJCE-UHFFFAOYSA-N
Synonyms

BUTYL2METHYL5(((245TRIMETHYLPHENYL)SULFONYL)AMINO)1BENZOFURAN3CARBOXYLATE
BUTYL2METHYL5((245TRIMETHYLPHENYL)SULFONYLAMINO)1BENZOFURAN3CARBOXYLATE
CCCCOC(=O)C1=C(OC2=C1C=C(C=C2)NS(=O)(=O)C3=C(C=C(C(=C3)C)C)C)C
InChI=1SC23H27NO5Sc167102823(25)2217(5)29209818(1319(20)22)2430(2627)211215(3)14(2)1116(21)4h89111324H6710H215H3
MFCD03471080
ZINC000002184861
ZINC02184861
ZINC2184861

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Available files

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