N-[2-[2-(4-chlorophenyl)sulfonylethylsulfanyl]phenyl]-3-methyl-benzenesulfonamide

Systemtic Name: N-[2-[2-(4-chlorophenyl)sulfonylethylsulfanyl]phenyl]-3-methyl-benzenesulfonamide Openeye Name: N-[2-[2-(4-chlorophenyl)sulfonylethylsulfanyl]phenyl]-3-methyl-benzenesulfonamide CAS Name: N-[2-[2-(4-chlorophenyl)sulfonylethylthio]phenyl]-3-methylbenzenesulfonamide IUPAC Name: N-[2-[2-(4-chlorophenyl)sulfonylethylsulfanyl]phenyl]-3-methylbenzenesulfonamide Traditional Name: N-[2-[2-(4-chlorophenyl)sulfonylethylthio]phenyl]-3-methyl-benzenesulfonamide Formula: C21H20ClNO4S3 MolecularWeight: 482.0358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)S(=O)(=O)NC2=CC=CC=C2SCCS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC(=CC=C1)S(=O)(=O)NC2=CC=CC=C2SCCS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H20ClNO4S3/c1-16-5-4-6-19(15-16)30(26,27)23-20-7-2-3-8-21(20)28-13-14-29(24,25)18-11-9-17(22)10-12-18/h2-12,15,23H,13-14H2,1H3