3-nitro-N-[4-(phenylsulfanylmethyl)phenyl]benzenesulfonamide

Systemtic Name: 3-nitro-N-[4-(phenylsulfanylmethyl)phenyl]benzenesulfonamide Openeye Name: 3-nitro-N-[4-(phenylsulfanylmethyl)phenyl]benzenesulfonamide CAS Name: 3-nitro-N-[4-[(phenylthio)methyl]phenyl]benzenesulfonamide IUPAC Name: 3-nitro-N-[4-(phenylsulfanylmethyl)phenyl]benzenesulfonamide Traditional Name: 3-nitro-N-[4-[(phenylthio)methyl]phenyl]benzenesulfonamide Formula: C19H16N2O4S2 MolecularWeight: 400.47134

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCC2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)SCC2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H16N2O4S2/c22-21(23)17-5-4-8-19(13-17)27(24,25)20-16-11-9-15(10-12-16)14-26-18-6-2-1-3-7-18/h1-13,20H,14H2