N-[(2-chlorophenyl)methyl]-3,4-dimethoxy-N-(2-oxidanylidene-2-piperazin-1-yl-ethyl)benzenesulfonamide

Systemtic Name: N-[(2-chlorophenyl)methyl]-3,4-dimethoxy-N-(2-oxidanylidene-2-piperazin-1-yl-ethyl)benzenesulfonamide Openeye Name: N-[(2-chlorophenyl)methyl]-3,4-dimethoxy-N-(2-oxo-2-piperazin-1-yl-ethyl)benzenesulfonamide CAS Name: N-[(2-chlorophenyl)methyl]-3,4-dimethoxy-N-[2-oxo-2-(1-piperazinyl)ethyl]benzenesulfonamide IUPAC Name: N-[(2-chlorophenyl)methyl]-3,4-dimethoxy-N-(2-oxo-2-piperazin-1-ylethyl)benzenesulfonamide Traditional Name: N-(2-chlorobenzyl)-N-(2-keto-2-piperazino-ethyl)-3,4-dimethoxy-benzenesulfonamide Formula: C21H26ClN3O5S MolecularWeight: 467.96624

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2Cl)CC(=O)N3CCNCC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2Cl)CC(=O)N3CCNCC3)OC

InChI

InChI=1S/C21H26ClN3O5S/c1-29-19-8-7-17(13-20(19)30-2)31(27,28)25(14-16-5-3-4-6-18(16)22)15-21(26)24-11-9-23-10-12-24/h3-8,13,23H,9-12,14-15H2,1-2H3