3-ethanoyl-N-[2-(phenylmethylsulfanyl)phenyl]benzenesulfonamide

Systemtic Name: 3-ethanoyl-N-[2-(phenylmethylsulfanyl)phenyl]benzenesulfonamide Openeye Name: 3-acetyl-N-(2-benzylsulfanylphenyl)benzenesulfonamide CAS Name: 3-acetyl-N-[2-(phenylmethylthio)phenyl]benzenesulfonamide IUPAC Name: 3-acetyl-N-(2-benzylsulfanylphenyl)benzenesulfonamide Traditional Name: 3-acetyl-N-[2-(benzylthio)phenyl]benzenesulfonamide Formula: C21H19NO3S2 MolecularWeight: 397.51046

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)S(=O)(=O)NC2=CC=CC=C2SCC3=CC=CC=C3

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)S(=O)(=O)NC2=CC=CC=C2SCC3=CC=CC=C3

InChI

InChI=1S/C21H19NO3S2/c1-16(23)18-10-7-11-19(14-18)27(24,25)22-20-12-5-6-13-21(20)26-15-17-8-3-2-4-9-17/h2-14,22H,15H2,1H3