2-nitro-N-[2-(phenylmethylsulfanyl)ethyl]benzenesulfonamide

Systemtic Name: 2-nitro-N-[2-(phenylmethylsulfanyl)ethyl]benzenesulfonamide Openeye Name: N-(2-benzylsulfanylethyl)-2-nitro-benzenesulfonamide CAS Name: 2-nitro-N-[2-(phenylmethylthio)ethyl]benzenesulfonamide IUPAC Name: N-(2-benzylsulfanylethyl)-2-nitrobenzenesulfonamide Traditional Name: N-[2-(benzylthio)ethyl]-2-nitro-benzenesulfonamide Formula: C15H16N2O4S2 MolecularWeight: 352.42854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCCNS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CSCCNS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C15H16N2O4S2/c18-17(19)14-8-4-5-9-15(14)23(20,21)16-10-11-22-12-13-6-2-1-3-7-13/h1-9,16H,10-12H2