N,2-dimethyl-N-[(4-methylsulfanylphenyl)methyl]-5-nitro-benzenesulfonamide

Systemtic Name: N,2-dimethyl-N-[(4-methylsulfanylphenyl)methyl]-5-nitro-benzenesulfonamide Openeye Name: N,2-dimethyl-N-[(4-methylsulfanylphenyl)methyl]-5-nitro-benzenesulfonamide CAS Name: N,2-dimethyl-N-[[4-(methylthio)phenyl]methyl]-5-nitrobenzenesulfonamide IUPAC Name: N,2-dimethyl-N-[(4-methylsulfanylphenyl)methyl]-5-nitrobenzenesulfonamide Traditional Name: N,2-dimethyl-N-[4-(methylthio)benzyl]-5-nitro-benzenesulfonamide Formula: C16H18N2O4S2 MolecularWeight: 366.45512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18N2O4S2/c1-12-4-7-14(18(19)20)10-16(12)24(21,22)17(2)11-13-5-8-15(23-3)9-6-13/h4-10H,11H2,1-3H3