2-[1-(4-methylphenyl)sulfonyl-3-oxidanylidene-piperazin-2-yl]-N-(pyridin-2-ylmethyl)ethanamide

Systemtic Name: 2-[1-(4-methylphenyl)sulfonyl-3-oxidanylidene-piperazin-2-yl]-N-(pyridin-2-ylmethyl)ethanamide Openeye Name: 2-[3-oxo-1-(p-tolylsulfonyl)piperazin-2-yl]-N-(2-pyridylmethyl)acetamide CAS Name: 2-[1-(4-methylphenyl)sulfonyl-3-oxo-2-piperazinyl]-N-(2-pyridinylmethyl)acetamide IUPAC Name: 2-[1-(4-methylphenyl)sulfonyl-3-oxopiperazin-2-yl]-N-(pyridin-2-ylmethyl)acetamide Traditional Name: 2-(3-keto-1-tosyl-piperazin-2-yl)-N-(2-pyridylmethyl)acetamide Formula: C19H22N4O4S MolecularWeight: 402.46738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCNC(=O)C2CC(=O)NCC3=CC=CC=N3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCNC(=O)C2CC(=O)NCC3=CC=CC=N3

InChI

InChI=1S/C19H22N4O4S/c1-14-5-7-16(8-6-14)28(26,27)23-11-10-21-19(25)17(23)12-18(24)22-13-15-4-2-3-9-20-15/h2-9,17H,10-13H2,1H3,(H,21,25)(H,22,24)