3,4-dimethyl-N-[4-[4-(2-nitrophenyl)piperazin-1-yl]carbonylphenyl]benzenesulfonamide

Systemtic Name: 3,4-dimethyl-N-[4-[4-(2-nitrophenyl)piperazin-1-yl]carbonylphenyl]benzenesulfonamide Openeye Name: 3,4-dimethyl-N-[4-[4-(2-nitrophenyl)piperazine-1-carbonyl]phenyl]benzenesulfonamide CAS Name: 3,4-dimethyl-N-[4-[[4-(2-nitrophenyl)-1-piperazinyl]-oxomethyl]phenyl]benzenesulfonamide IUPAC Name: 3,4-dimethyl-N-[4-[4-(2-nitrophenyl)piperazine-1-carbonyl]phenyl]benzenesulfonamide Traditional Name: 3,4-dimethyl-N-[4-[4-(2-nitrophenyl)piperazine-1-carbonyl]phenyl]benzenesulfonamide Formula: C25H26N4O5S MolecularWeight: 494.56274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=CC=CC=C4[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=CC=CC=C4[N+](=O)[O-])C

InChI

InChI=1S/C25H26N4O5S/c1-18-7-12-22(17-19(18)2)35(33,34)26-21-10-8-20(9-11-21)25(30)28-15-13-27(14-16-28)23-5-3-4-6-24(23)29(31)32/h3-12,17,26H,13-16H2,1-2H3