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

Systemtic Name: N-[(3-chlorophenyl)methyl]-4-methoxy-N-(3-oxidanylidene-3-piperazin-1-yl-propyl)benzenesulfonamide Openeye Name: N-[(3-chlorophenyl)methyl]-4-methoxy-N-(3-oxo-3-piperazin-1-yl-propyl)benzenesulfonamide CAS Name: N-[(3-chlorophenyl)methyl]-4-methoxy-N-[3-oxo-3-(1-piperazinyl)propyl]benzenesulfonamide IUPAC Name: N-[(3-chlorophenyl)methyl]-4-methoxy-N-(3-oxo-3-piperazin-1-ylpropyl)benzenesulfonamide Traditional Name: N-(3-chlorobenzyl)-N-(3-keto-3-piperazino-propyl)-4-methoxy-benzenesulfonamide Formula: C21H26ClN3O4S MolecularWeight: 451.96684

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N(CCC(=O)N2CCNCC2)CC3=CC(=CC=C3)Cl

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N(CCC(=O)N2CCNCC2)CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H26ClN3O4S/c1-29-19-5-7-20(8-6-19)30(27,28)25(16-17-3-2-4-18(22)15-17)12-9-21(26)24-13-10-23-11-14-24/h2-8,15,23H,9-14,16H2,1H3