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

Systemtic Name: N-[(3-methylphenyl)methyl]-4-(2-methylpropyl)-N-(2-oxidanylidene-2-piperazin-1-yl-ethyl)benzenesulfonamide Openeye Name: 4-isobutyl-N-(m-tolylmethyl)-N-(2-oxo-2-piperazin-1-yl-ethyl)benzenesulfonamide CAS Name: N-[(3-methylphenyl)methyl]-4-(2-methylpropyl)-N-[2-oxo-2-(1-piperazinyl)ethyl]benzenesulfonamide IUPAC Name: N-[(3-methylphenyl)methyl]-4-(2-methylpropyl)-N-(2-oxo-2-piperazin-1-ylethyl)benzenesulfonamide Traditional Name: 4-isobutyl-N-(2-keto-2-piperazino-ethyl)-N-(3-methylbenzyl)benzenesulfonamide Formula: C24H33N3O3S MolecularWeight: 443.60212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H33N3O3S/c1-19(2)15-21-7-9-23(10-8-21)31(29,30)27(17-22-6-4-5-20(3)16-22)18-24(28)26-13-11-25-12-14-26/h4-10,16,19,25H,11-15,17-18H2,1-3H3