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

Systemtic Name: N-[4,5-bis[(4-methylphenyl)sulfonylamino]-2-nitro-phenyl]-2-methyl-benzenesulfonamide Openeye Name: 2-methyl-N-[2-nitro-4,5-bis(p-tolylsulfonylamino)phenyl]benzenesulfonamide CAS Name: N-[4,5-bis[(4-methylphenyl)sulfonylamino]-2-nitrophenyl]-2-methylbenzenesulfonamide IUPAC Name: N-[4,5-bis[(4-methylphenyl)sulfonylamino]-2-nitrophenyl]-2-methylbenzenesulfonamide Traditional Name: 2-methyl-N-[2-nitro-4,5-bis(tosylamino)phenyl]benzenesulfonamide Formula: C27H26N4O8S3 MolecularWeight: 630.71234

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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)[N+](=O)[O-])NS(=O)(=O)C4=CC=CC=C4C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C=C2NS(=O)(=O)C3=CC=C(C=C3)C)[N+](=O)[O-])NS(=O)(=O)C4=CC=CC=C4C

InChI

InChI=1S/C27H26N4O8S3/c1-18-8-12-21(13-9-18)40(34,35)28-23-16-25(30-42(38,39)27-7-5-4-6-20(27)3)26(31(32)33)17-24(23)29-41(36,37)22-14-10-19(2)11-15-22/h4-17,28-30H,1-3H3