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

Systemtic Name: 3-methyl-N-[(3-methylphenyl)methyl]-N-(3-oxidanylidene-3-piperazin-1-yl-propyl)benzenesulfonamide Openeye Name: 3-methyl-N-(m-tolylmethyl)-N-(3-oxo-3-piperazin-1-yl-propyl)benzenesulfonamide CAS Name: 3-methyl-N-[(3-methylphenyl)methyl]-N-[3-oxo-3-(1-piperazinyl)propyl]benzenesulfonamide IUPAC Name: 3-methyl-N-[(3-methylphenyl)methyl]-N-(3-oxo-3-piperazin-1-ylpropyl)benzenesulfonamide Traditional Name: N-(3-keto-3-piperazino-propyl)-3-methyl-N-(3-methylbenzyl)benzenesulfonamide Formula: C22H29N3O3S MolecularWeight: 415.54896

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29N3O3S/c1-18-5-3-7-20(15-18)17-25(12-9-22(26)24-13-10-23-11-14-24)29(27,28)21-8-4-6-19(2)16-21/h3-8,15-16,23H,9-14,17H2,1-2H3