N-[2-[2-(4-chlorophenyl)sulfonylethylsulfanyl]phenyl]-2,5-dimethoxy-benzenesulfonamide

Systemtic Name: N-[2-[2-(4-chlorophenyl)sulfonylethylsulfanyl]phenyl]-2,5-dimethoxy-benzenesulfonamide Openeye Name: N-[2-[2-(4-chlorophenyl)sulfonylethylsulfanyl]phenyl]-2,5-dimethoxy-benzenesulfonamide CAS Name: N-[2-[2-(4-chlorophenyl)sulfonylethylthio]phenyl]-2,5-dimethoxybenzenesulfonamide IUPAC Name: N-[2-[2-(4-chlorophenyl)sulfonylethylsulfanyl]phenyl]-2,5-dimethoxybenzenesulfonamide Traditional Name: N-[2-[2-(4-chlorophenyl)sulfonylethylthio]phenyl]-2,5-dimethoxy-benzenesulfonamide Formula: C22H22ClNO6S3 MolecularWeight: 528.06118

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)S(=O)(=O)NC2=CC=CC=C2SCCS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

COC1=CC(=C(C=C1)OC)S(=O)(=O)NC2=CC=CC=C2SCCS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H22ClNO6S3/c1-29-17-9-12-20(30-2)22(15-17)33(27,28)24-19-5-3-4-6-21(19)31-13-14-32(25,26)18-10-7-16(23)8-11-18/h3-12,15,24H,13-14H2,1-2H3