N-(3,4-dimethylphenyl)-4-[4-(phenylcarbonyl)piperazin-1-yl]carbonyl-benzenesulfonamide

Systemtic Name: N-(3,4-dimethylphenyl)-4-[4-(phenylcarbonyl)piperazin-1-yl]carbonyl-benzenesulfonamide Openeye Name: 4-(4-benzoylpiperazine-1-carbonyl)-N-(3,4-dimethylphenyl)benzenesulfonamide CAS Name: 4-[(4-benzoyl-1-piperazinyl)-oxomethyl]-N-(3,4-dimethylphenyl)benzenesulfonamide IUPAC Name: 4-(4-benzoylpiperazine-1-carbonyl)-N-(3,4-dimethylphenyl)benzenesulfonamide Traditional Name: 4-(4-benzoylpiperazine-1-carbonyl)-N-(3,4-dimethylphenyl)benzenesulfonamide Formula: C26H27N3O4S MolecularWeight: 477.57528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCN(CC3)C(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCN(CC3)C(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C26H27N3O4S/c1-19-8-11-23(18-20(19)2)27-34(32,33)24-12-9-22(10-13-24)26(31)29-16-14-28(15-17-29)25(30)21-6-4-3-5-7-21/h3-13,18,27H,14-17H2,1-2H3