N-(2-methyl-3-nitro-phenyl)-4-methylsulfanyl-benzenesulfonamide

Systemtic Name: N-(2-methyl-3-nitro-phenyl)-4-methylsulfanyl-benzenesulfonamide Openeye Name: N-(2-methyl-3-nitro-phenyl)-4-methylsulfanyl-benzenesulfonamide CAS Name: N-(2-methyl-3-nitrophenyl)-4-(methylthio)benzenesulfonamide IUPAC Name: N-(2-methyl-3-nitrophenyl)-4-methylsulfanylbenzenesulfonamide Traditional Name: N-(2-methyl-3-nitro-phenyl)-4-(methylthio)benzenesulfonamide Formula: C14H14N2O4S2 MolecularWeight: 338.40196

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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