3-cyano-N-[4-(2,4-dimethylphenyl)sulfanylphenyl]benzenesulfonamide

Systemtic Name: 3-cyano-N-[4-(2,4-dimethylphenyl)sulfanylphenyl]benzenesulfonamide Openeye Name: 3-cyano-N-[4-(2,4-dimethylphenyl)sulfanylphenyl]benzenesulfonamide CAS Name: 3-cyano-N-[4-[(2,4-dimethylphenyl)thio]phenyl]benzenesulfonamide IUPAC Name: 3-cyano-N-[4-(2,4-dimethylphenyl)sulfanylphenyl]benzenesulfonamide Traditional Name: 3-cyano-N-[4-[(2,4-dimethylphenyl)thio]phenyl]benzenesulfonamide Formula: C21H18N2O2S2 MolecularWeight: 394.50982

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)SC2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC(=C3)C#N)C

Isomeric SMILES

CC1=CC(=C(C=C1)SC2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC(=C3)C#N)C

InChI

InChI=1S/C21H18N2O2S2/c1-15-6-11-21(16(2)12-15)26-19-9-7-18(8-10-19)23-27(24,25)20-5-3-4-17(13-20)14-22/h3-13,23H,1-2H3