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

Systemtic Name: 3-methyl-N-[(4-methylphenyl)methyl]-N-(3-oxidanylidene-3-piperazin-1-yl-propyl)benzenesulfonamide Openeye Name: 3-methyl-N-(3-oxo-3-piperazin-1-yl-propyl)-N-(p-tolylmethyl)benzenesulfonamide CAS Name: 3-methyl-N-[(4-methylphenyl)methyl]-N-[3-oxo-3-(1-piperazinyl)propyl]benzenesulfonamide IUPAC Name: 3-methyl-N-[(4-methylphenyl)methyl]-N-(3-oxo-3-piperazin-1-ylpropyl)benzenesulfonamide Traditional Name: N-(3-keto-3-piperazino-propyl)-3-methyl-N-(4-methylbenzyl)benzenesulfonamide Formula: C22H29N3O3S MolecularWeight: 415.54896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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