N-[(4-methylphenyl)methyl]-4-(2-methylpropyl)-N-(3-oxidanylidene-3-piperazin-1-yl-propyl)benzenesulfonamide

Systemtic Name: N-[(4-methylphenyl)methyl]-4-(2-methylpropyl)-N-(3-oxidanylidene-3-piperazin-1-yl-propyl)benzenesulfonamide Openeye Name: 4-isobutyl-N-(3-oxo-3-piperazin-1-yl-propyl)-N-(p-tolylmethyl)benzenesulfonamide CAS Name: N-[(4-methylphenyl)methyl]-4-(2-methylpropyl)-N-[3-oxo-3-(1-piperazinyl)propyl]benzenesulfonamide IUPAC Name: N-[(4-methylphenyl)methyl]-4-(2-methylpropyl)-N-(3-oxo-3-piperazin-1-ylpropyl)benzenesulfonamide Traditional Name: 4-isobutyl-N-(3-keto-3-piperazino-propyl)-N-(4-methylbenzyl)benzenesulfonamide Formula: C25H35N3O3S MolecularWeight: 457.6287

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(CCC(=O)N2CCNCC2)S(=O)(=O)C3=CC=C(C=C3)CC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)CN(CCC(=O)N2CCNCC2)S(=O)(=O)C3=CC=C(C=C3)CC(C)C

InChI

InChI=1S/C25H35N3O3S/c1-20(2)18-22-8-10-24(11-9-22)32(30,31)28(19-23-6-4-21(3)5-7-23)15-12-25(29)27-16-13-26-14-17-27/h4-11,20,26H,12-19H2,1-3H3