4-ethyl-N-[2-(4-methylpiperazin-1-yl)ethyl]-N-(3-oxidanylidene-3-piperazin-1-yl-propyl)benzenesulfonamide

Systemtic Name: 4-ethyl-N-[2-(4-methylpiperazin-1-yl)ethyl]-N-(3-oxidanylidene-3-piperazin-1-yl-propyl)benzenesulfonamide Openeye Name: 4-ethyl-N-[2-(4-methylpiperazin-1-yl)ethyl]-N-(3-oxo-3-piperazin-1-yl-propyl)benzenesulfonamide CAS Name: 4-ethyl-N-[2-(4-methyl-1-piperazinyl)ethyl]-N-[3-oxo-3-(1-piperazinyl)propyl]benzenesulfonamide IUPAC Name: 4-ethyl-N-[2-(4-methylpiperazin-1-yl)ethyl]-N-(3-oxo-3-piperazin-1-ylpropyl)benzenesulfonamide Traditional Name: 4-ethyl-N-(3-keto-3-piperazino-propyl)-N-[2-(4-methylpiperazino)ethyl]benzenesulfonamide Formula: C22H37N5O3S MolecularWeight: 451.62588

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)S(=O)(=O)N(CCC(=O)N2CCNCC2)CCN3CCN(CC3)C

Isomeric SMILES

CCC1=CC=C(C=C1)S(=O)(=O)N(CCC(=O)N2CCNCC2)CCN3CCN(CC3)C

InChI

InChI=1S/C22H37N5O3S/c1-3-20-4-6-21(7-5-20)31(29,30)27(19-18-25-16-14-24(2)15-17-25)11-8-22(28)26-12-9-23-10-13-26/h4-7,23H,3,8-19H2,1-2H3