N-[3-[2-(4-cyanophenyl)ethylsulfanyl]phenyl]benzenesulfonamide

Systemtic Name: N-[3-[2-(4-cyanophenyl)ethylsulfanyl]phenyl]benzenesulfonamide Openeye Name: N-[3-[2-(4-cyanophenyl)ethylsulfanyl]phenyl]benzenesulfonamide CAS Name: N-[3-[2-(4-cyanophenyl)ethylthio]phenyl]benzenesulfonamide IUPAC Name: N-[3-[2-(4-cyanophenyl)ethylsulfanyl]phenyl]benzenesulfonamide Traditional Name: N-[3-[2-(4-cyanophenyl)ethylthio]phenyl]benzenesulfonamide Formula: C21H18N2O2S2 MolecularWeight: 394.50982

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)NC2=CC(=CC=C2)SCCC3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)NC2=CC(=CC=C2)SCCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H18N2O2S2/c22-16-18-11-9-17(10-12-18)13-14-26-20-6-4-5-19(15-20)23-27(24,25)21-7-2-1-3-8-21/h1-12,15,23H,13-14H2