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

Systemtic Name: N-[5-(cyclohexylamino)-2-[(4-methylphenyl)sulfonylamino]-4-nitro-phenyl]-4-methyl-benzenesulfonamide Openeye Name: N-[5-(cyclohexylamino)-4-nitro-2-(p-tolylsulfonylamino)phenyl]-4-methyl-benzenesulfonamide CAS Name: N-[5-(cyclohexylamino)-2-[(4-methylphenyl)sulfonylamino]-4-nitrophenyl]-4-methylbenzenesulfonamide IUPAC Name: N-[5-(cyclohexylamino)-2-[(4-methylphenyl)sulfonylamino]-4-nitrophenyl]-4-methylbenzenesulfonamide Traditional Name: N-[5-(cyclohexylamino)-4-nitro-2-(tosylamino)phenyl]-4-methyl-benzenesulfonamide Formula: C26H30N4O6S2 MolecularWeight: 558.6696

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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-])NC4CCCCC4

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-])NC4CCCCC4

InChI

InChI=1S/C26H30N4O6S2/c1-18-8-12-21(13-9-18)37(33,34)28-23-16-25(27-20-6-4-3-5-7-20)26(30(31)32)17-24(23)29-38(35,36)22-14-10-19(2)11-15-22/h8-17,20,27-29H,3-7H2,1-2H3