N-[2-(4-methylphenyl)sulfanylethyl]-1-(3-nitrophenyl)methanesulfonamide

Systemtic Name: N-[2-(4-methylphenyl)sulfanylethyl]-1-(3-nitrophenyl)methanesulfonamide Openeye Name: 1-(3-nitrophenyl)-N-[2-(p-tolylsulfanyl)ethyl]methanesulfonamide CAS Name: N-[2-[(4-methylphenyl)thio]ethyl]-1-(3-nitrophenyl)methanesulfonamide IUPAC Name: N-[2-(4-methylphenyl)sulfanylethyl]-1-(3-nitrophenyl)methanesulfonamide Traditional Name: 1-(3-nitrophenyl)-N-[2-(p-tolylthio)ethyl]methanesulfonamide Formula: C16H18N2O4S2 MolecularWeight: 366.45512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCNS(=O)(=O)CC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)SCCNS(=O)(=O)CC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H18N2O4S2/c1-13-5-7-16(8-6-13)23-10-9-17-24(21,22)12-14-3-2-4-15(11-14)18(19)20/h2-8,11,17H,9-10,12H2,1H3