N-methyl-N-[(4-methylsulfanylphenyl)methyl]-4-nitro-benzenesulfonamide

Systemtic Name: N-methyl-N-[(4-methylsulfanylphenyl)methyl]-4-nitro-benzenesulfonamide Openeye Name: N-methyl-N-[(4-methylsulfanylphenyl)methyl]-4-nitro-benzenesulfonamide CAS Name: N-methyl-N-[[4-(methylthio)phenyl]methyl]-4-nitrobenzenesulfonamide IUPAC Name: N-methyl-N-[(4-methylsulfanylphenyl)methyl]-4-nitrobenzenesulfonamide Traditional Name: N-methyl-N-[4-(methylthio)benzyl]-4-nitro-benzenesulfonamide Formula: C15H16N2O4S2 MolecularWeight: 352.42854

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)SC)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=CC=C(C=C1)SC)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H16N2O4S2/c1-16(11-12-3-7-14(22-2)8-4-12)23(20,21)15-9-5-13(6-10-15)17(18)19/h3-10H,11H2,1-2H3