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

Systemtic Name: N-[2-[2-(4-chlorophenyl)sulfonylethylsulfanyl]phenyl]-4-cyano-benzenesulfonamide Openeye Name: N-[2-[2-(4-chlorophenyl)sulfonylethylsulfanyl]phenyl]-4-cyano-benzenesulfonamide CAS Name: N-[2-[2-(4-chlorophenyl)sulfonylethylthio]phenyl]-4-cyanobenzenesulfonamide IUPAC Name: N-[2-[2-(4-chlorophenyl)sulfonylethylsulfanyl]phenyl]-4-cyanobenzenesulfonamide Traditional Name: N-[2-[2-(4-chlorophenyl)sulfonylethylthio]phenyl]-4-cyano-benzenesulfonamide Formula: C21H17ClN2O4S3 MolecularWeight: 493.01868

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NS(=O)(=O)C2=CC=C(C=C2)C#N)SCCS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C(C(=C1)NS(=O)(=O)C2=CC=C(C=C2)C#N)SCCS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H17ClN2O4S3/c22-17-7-11-18(12-8-17)30(25,26)14-13-29-21-4-2-1-3-20(21)24-31(27,28)19-9-5-16(15-23)6-10-19/h1-12,24H,13-14H2