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

Systemtic Name: N-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]carbonylphenyl]benzenesulfonamide Openeye Name: N-[3-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]phenyl]benzenesulfonamide CAS Name: N-[3-[[4-(2,3-dimethylphenyl)-1-piperazinyl]-oxomethyl]phenyl]benzenesulfonamide IUPAC Name: N-[3-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]phenyl]benzenesulfonamide Traditional Name: N-[3-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]phenyl]benzenesulfonamide Formula: C25H27N3O3S MolecularWeight: 449.56518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3=CC(=CC=C3)NS(=O)(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3=CC(=CC=C3)NS(=O)(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C25H27N3O3S/c1-19-8-6-13-24(20(19)2)27-14-16-28(17-15-27)25(29)21-9-7-10-22(18-21)26-32(30,31)23-11-4-3-5-12-23/h3-13,18,26H,14-17H2,1-2H3