N-[4-(2,6-dimethylphenyl)sulfanyl-2-[(4-methylphenyl)sulfonylamino]-5-nitro-phenyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[4-(2,6-dimethylphenyl)sulfanyl-2-[(4-methylphenyl)sulfonylamino]-5-nitro-phenyl]-4-methyl-benzenesulfonamide Openeye Name: N-[4-(2,6-dimethylphenyl)sulfanyl-5-nitro-2-(p-tolylsulfonylamino)phenyl]-4-methyl-benzenesulfonamide CAS Name: N-[4-[(2,6-dimethylphenyl)thio]-2-[(4-methylphenyl)sulfonylamino]-5-nitrophenyl]-4-methylbenzenesulfonamide IUPAC Name: N-[4-(2,6-dimethylphenyl)sulfanyl-2-[(4-methylphenyl)sulfonylamino]-5-nitrophenyl]-4-methylbenzenesulfonamide Traditional Name: N-[4-[(2,6-dimethylphenyl)thio]-5-nitro-2-(tosylamino)phenyl]-4-methyl-benzenesulfonamide Formula: C28H27N3O6S3 MolecularWeight: 597.72548

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C=C2NS(=O)(=O)C3=CC=C(C=C3)C)SC4=C(C=CC=C4C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C=C2NS(=O)(=O)C3=CC=C(C=C3)C)SC4=C(C=CC=C4C)C)[N+](=O)[O-]

InChI

InChI=1S/C28H27N3O6S3/c1-18-8-12-22(13-9-18)39(34,35)29-24-16-26(31(32)33)27(38-28-20(3)6-5-7-21(28)4)17-25(24)30-40(36,37)23-14-10-19(2)11-15-23/h5-17,29-30H,1-4H3