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

Systemtic Name: N-[(3-chlorophenyl)methyl]-4-ethyl-N-(3-oxidanylidene-3-piperazin-1-yl-propyl)benzenesulfonamide Openeye Name: N-[(3-chlorophenyl)methyl]-4-ethyl-N-(3-oxo-3-piperazin-1-yl-propyl)benzenesulfonamide CAS Name: N-[(3-chlorophenyl)methyl]-4-ethyl-N-[3-oxo-3-(1-piperazinyl)propyl]benzenesulfonamide IUPAC Name: N-[(3-chlorophenyl)methyl]-4-ethyl-N-(3-oxo-3-piperazin-1-ylpropyl)benzenesulfonamide Traditional Name: N-(3-chlorobenzyl)-4-ethyl-N-(3-keto-3-piperazino-propyl)benzenesulfonamide Formula: C22H28ClN3O3S MolecularWeight: 449.99402

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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)Cl

Isomeric SMILES

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

InChI

InChI=1S/C22H28ClN3O3S/c1-2-18-6-8-21(9-7-18)30(28,29)26(17-19-4-3-5-20(23)16-19)13-10-22(27)25-14-11-24-12-15-25/h3-9,16,24H,2,10-15,17H2,1H3