Vitas-M small molecule compound

N-(3-acetyl-7-chloro-2-methyl-1-benzofuran-5-yl)-4-tert-butylbenzenesulfonamide

Catalog ID
STK238306
SMILES CC(=O)c1c(C)oc2c1cc(cc2Cl)NS(=O)(=O)c1ccc(cc1)C(C)(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 C21H22ClNO4S MW 419.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22ClNO4S/c1-12(24)19-13(2)27-20-17(19)10-15(11-18(20)22)23-28(25,26)16-8-6-14(7-9-16)21(3,4)5/h6-11,23H,1-5H3
InChIKey
OXDIQSKQEXPFFA-UHFFFAOYSA-N
Synonyms

CC1=C(C2=CC(=CC(=C2O1)Cl)NS(=O)(=O)C3=CC=C(C=C3)C(C)(C)C)C(=O)C
InChI=1SC21H22ClNO4Sc112(24)1913(2)272017(19)1015(1118(20)22)2328(2526)168614(7916)21(34)5h61123H15H3
MFCD02084682
N(3acetyl7chloro2methyl1benzofuran5yl)4tertbutylbenzenesulfonamide
ZINC000000944063
ZINC00944063
ZINC944063

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Available files

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