N-[2-(4-methylphenyl)sulfanylethyl]-4-nitro-benzenesulfonamide

Systemtic Name: N-[2-(4-methylphenyl)sulfanylethyl]-4-nitro-benzenesulfonamide Openeye Name: 4-nitro-N-[2-(p-tolylsulfanyl)ethyl]benzenesulfonamide CAS Name: N-[2-[(4-methylphenyl)thio]ethyl]-4-nitrobenzenesulfonamide IUPAC Name: N-[2-(4-methylphenyl)sulfanylethyl]-4-nitrobenzenesulfonamide Traditional Name: 4-nitro-N-[2-(p-tolylthio)ethyl]benzenesulfonamide Formula: C15H16N2O4S2 MolecularWeight: 352.42854

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H16N2O4S2/c1-12-2-6-14(7-3-12)22-11-10-16-23(20,21)15-8-4-13(5-9-15)17(18)19/h2-9,16H,10-11H2,1H3