4-[2,3-bis(oxidanylidene)-4-(pyridin-2-ylmethyl)piperazin-1-yl]-N-(3-methylphenyl)piperidine-1-carboxamide

Systemtic Name: 4-[2,3-bis(oxidanylidene)-4-(pyridin-2-ylmethyl)piperazin-1-yl]-N-(3-methylphenyl)piperidine-1-carboxamide Openeye Name: 4-[2,3-dioxo-4-(2-pyridylmethyl)piperazin-1-yl]-N-(m-tolyl)piperidine-1-carboxamide CAS Name: 4-[2,3-dioxo-4-(2-pyridinylmethyl)-1-piperazinyl]-N-(3-methylphenyl)-1-piperidinecarboxamide IUPAC Name: 4-[2,3-dioxo-4-(pyridin-2-ylmethyl)piperazin-1-yl]-N-(3-methylphenyl)piperidine-1-carboxamide Traditional Name: 4-[2,3-diketo-4-(2-pyridylmethyl)piperazino]-N-(m-tolyl)piperidine-1-carboxamide Formula: C23H27N5O3 MolecularWeight: 421.49218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)N2CCC(CC2)N3CCN(C(=O)C3=O)CC4=CC=CC=N4

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)N2CCC(CC2)N3CCN(C(=O)C3=O)CC4=CC=CC=N4

InChI

InChI=1S/C23H27N5O3/c1-17-5-4-7-18(15-17)25-23(31)26-11-8-20(9-12-26)28-14-13-27(21(29)22(28)30)16-19-6-2-3-10-24-19/h2-7,10,15,20H,8-9,11-14,16H2,1H3,(H,25,31)