2,5-dimethoxy-N-[(3-methylphenyl)methyl]-N-(3-oxidanylidene-3-piperazin-1-yl-propyl)benzenesulfonamide

Systemtic Name: 2,5-dimethoxy-N-[(3-methylphenyl)methyl]-N-(3-oxidanylidene-3-piperazin-1-yl-propyl)benzenesulfonamide Openeye Name: 2,5-dimethoxy-N-(m-tolylmethyl)-N-(3-oxo-3-piperazin-1-yl-propyl)benzenesulfonamide CAS Name: 2,5-dimethoxy-N-[(3-methylphenyl)methyl]-N-[3-oxo-3-(1-piperazinyl)propyl]benzenesulfonamide IUPAC Name: 2,5-dimethoxy-N-[(3-methylphenyl)methyl]-N-(3-oxo-3-piperazin-1-ylpropyl)benzenesulfonamide Traditional Name: N-(3-keto-3-piperazino-propyl)-2,5-dimethoxy-N-(3-methylbenzyl)benzenesulfonamide Formula: C23H31N3O5S MolecularWeight: 461.57434

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H31N3O5S/c1-18-5-4-6-19(15-18)17-26(12-9-23(27)25-13-10-24-11-14-25)32(28,29)22-16-20(30-2)7-8-21(22)31-3/h4-8,15-16,24H,9-14,17H2,1-3H3