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

Systemtic Name: 4-ethoxy-N-[(4-methylphenyl)methyl]-N-(3-oxidanylidene-3-piperazin-1-yl-propyl)benzenesulfonamide Openeye Name: 4-ethoxy-N-(3-oxo-3-piperazin-1-yl-propyl)-N-(p-tolylmethyl)benzenesulfonamide CAS Name: 4-ethoxy-N-[(4-methylphenyl)methyl]-N-[3-oxo-3-(1-piperazinyl)propyl]benzenesulfonamide IUPAC Name: 4-ethoxy-N-[(4-methylphenyl)methyl]-N-(3-oxo-3-piperazin-1-ylpropyl)benzenesulfonamide Traditional Name: 4-ethoxy-N-(3-keto-3-piperazino-propyl)-N-(4-methylbenzyl)benzenesulfonamide Formula: C23H31N3O4S MolecularWeight: 445.57494

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N(CCC(=O)N2CCNCC2)CC3=CC=C(C=C3)C

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N(CCC(=O)N2CCNCC2)CC3=CC=C(C=C3)C

InChI

InChI=1S/C23H31N3O4S/c1-3-30-21-8-10-22(11-9-21)31(28,29)26(18-20-6-4-19(2)5-7-20)15-12-23(27)25-16-13-24-14-17-25/h4-11,24H,3,12-18H2,1-2H3