N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[3-oxidanylidene-1-(phenylsulfonyl)piperazin-2-yl]ethanamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[3-oxidanylidene-1-(phenylsulfonyl)piperazin-2-yl]ethanamide Openeye Name: 2-[1-(benzenesulfonyl)-3-oxo-piperazin-2-yl]-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide CAS Name: 2-[1-(benzenesulfonyl)-3-oxo-2-piperazinyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide IUPAC Name: 2-[1-(benzenesulfonyl)-3-oxopiperazin-2-yl]-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide Traditional Name: 2-(1-besyl-3-keto-piperazin-2-yl)-N-homoveratryl-acetamide Formula: C22H27N3O6S MolecularWeight: 461.53128

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)CC2C(=O)NCCN2S(=O)(=O)C3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)CC2C(=O)NCCN2S(=O)(=O)C3=CC=CC=C3)OC

InChI

InChI=1S/C22H27N3O6S/c1-30-19-9-8-16(14-20(19)31-2)10-11-23-21(26)15-18-22(27)24-12-13-25(18)32(28,29)17-6-4-3-5-7-17/h3-9,14,18H,10-13,15H2,1-2H3,(H,23,26)(H,24,27)