2-methyl-N-(2-methylsulfanylphenyl)-5-nitro-benzenesulfonamide

Systemtic Name: 2-methyl-N-(2-methylsulfanylphenyl)-5-nitro-benzenesulfonamide Openeye Name: 2-methyl-N-(2-methylsulfanylphenyl)-5-nitro-benzenesulfonamide CAS Name: 2-methyl-N-[2-(methylthio)phenyl]-5-nitrobenzenesulfonamide IUPAC Name: 2-methyl-N-(2-methylsulfanylphenyl)-5-nitrobenzenesulfonamide Traditional Name: 2-methyl-N-[2-(methylthio)phenyl]-5-nitro-benzenesulfonamide Formula: C14H14N2O4S2 MolecularWeight: 338.40196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NC2=CC=CC=C2SC

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NC2=CC=CC=C2SC

InChI

InChI=1S/C14H14N2O4S2/c1-10-7-8-11(16(17)18)9-14(10)22(19,20)15-12-5-3-4-6-13(12)21-2/h3-9,15H,1-2H3