4-cyano-N-[2-(phenylmethylsulfanyl)phenyl]benzenesulfonamide

Systemtic Name: 4-cyano-N-[2-(phenylmethylsulfanyl)phenyl]benzenesulfonamide Openeye Name: N-(2-benzylsulfanylphenyl)-4-cyano-benzenesulfonamide CAS Name: 4-cyano-N-[2-(phenylmethylthio)phenyl]benzenesulfonamide IUPAC Name: N-(2-benzylsulfanylphenyl)-4-cyanobenzenesulfonamide Traditional Name: N-[2-(benzylthio)phenyl]-4-cyano-benzenesulfonamide Formula: C20H16N2O2S2 MolecularWeight: 380.48324

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=CC=CC=C2NS(=O)(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC=C(C=C1)CSC2=CC=CC=C2NS(=O)(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C20H16N2O2S2/c21-14-16-10-12-18(13-11-16)26(23,24)22-19-8-4-5-9-20(19)25-15-17-6-2-1-3-7-17/h1-13,22H,15H2