2-[3-oxidanylidene-1-(phenylsulfonyl)piperazin-2-yl]-N-(3,4,5-trimethoxyphenyl)ethanamide

Systemtic Name: 2-[3-oxidanylidene-1-(phenylsulfonyl)piperazin-2-yl]-N-(3,4,5-trimethoxyphenyl)ethanamide Openeye Name: 2-[1-(benzenesulfonyl)-3-oxo-piperazin-2-yl]-N-(3,4,5-trimethoxyphenyl)acetamide CAS Name: 2-[1-(benzenesulfonyl)-3-oxo-2-piperazinyl]-N-(3,4,5-trimethoxyphenyl)acetamide IUPAC Name: 2-[1-(benzenesulfonyl)-3-oxopiperazin-2-yl]-N-(3,4,5-trimethoxyphenyl)acetamide Traditional Name: 2-(1-besyl-3-keto-piperazin-2-yl)-N-(3,4,5-trimethoxyphenyl)acetamide Formula: C21H25N3O7S MolecularWeight: 463.5041

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC(=O)CC2C(=O)NCCN2S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC(=O)CC2C(=O)NCCN2S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H25N3O7S/c1-29-17-11-14(12-18(30-2)20(17)31-3)23-19(25)13-16-21(26)22-9-10-24(16)32(27,28)15-7-5-4-6-8-15/h4-8,11-12,16H,9-10,13H2,1-3H3,(H,22,26)(H,23,25)