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

Systemtic Name: 4-ethyl-N-[(3-methylphenyl)methyl]-N-(3-oxidanylidene-3-piperazin-1-yl-propyl)benzenesulfonamide Openeye Name: 4-ethyl-N-(m-tolylmethyl)-N-(3-oxo-3-piperazin-1-yl-propyl)benzenesulfonamide CAS Name: 4-ethyl-N-[(3-methylphenyl)methyl]-N-[3-oxo-3-(1-piperazinyl)propyl]benzenesulfonamide IUPAC Name: 4-ethyl-N-[(3-methylphenyl)methyl]-N-(3-oxo-3-piperazin-1-ylpropyl)benzenesulfonamide Traditional Name: 4-ethyl-N-(3-keto-3-piperazino-propyl)-N-(3-methylbenzyl)benzenesulfonamide Formula: C23H31N3O3S MolecularWeight: 429.57554

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)S(=O)(=O)N(CCC(=O)N2CCNCC2)CC3=CC=CC(=C3)C

Isomeric SMILES

CCC1=CC=C(C=C1)S(=O)(=O)N(CCC(=O)N2CCNCC2)CC3=CC=CC(=C3)C

InChI

InChI=1S/C23H31N3O3S/c1-3-20-7-9-22(10-8-20)30(28,29)26(18-21-6-4-5-19(2)17-21)14-11-23(27)25-15-12-24-13-16-25/h4-10,17,24H,3,11-16,18H2,1-2H3