4-(2-methylpropyl)-3-[2-oxidanylidene-2-[4-(pyridin-2-ylmethyl)piperazin-1-yl]ethyl]piperazin-2-one

Systemtic Name: 4-(2-methylpropyl)-3-[2-oxidanylidene-2-[4-(pyridin-2-ylmethyl)piperazin-1-yl]ethyl]piperazin-2-one Openeye Name: 4-isobutyl-3-[2-oxo-2-[4-(2-pyridylmethyl)piperazin-1-yl]ethyl]piperazin-2-one CAS Name: 4-(2-methylpropyl)-3-[2-oxo-2-[4-(2-pyridinylmethyl)-1-piperazinyl]ethyl]-2-piperazinone IUPAC Name: 4-(2-methylpropyl)-3-[2-oxo-2-[4-(pyridin-2-ylmethyl)piperazin-1-yl]ethyl]piperazin-2-one Traditional Name: 4-isobutyl-3-[2-keto-2-[4-(2-pyridylmethyl)piperazino]ethyl]piperazin-2-one Formula: C20H31N5O2 MolecularWeight: 373.49244

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1CCNC(=O)C1CC(=O)N2CCN(CC2)CC3=CC=CC=N3

Isomeric SMILES

CC(C)CN1CCNC(=O)C1CC(=O)N2CCN(CC2)CC3=CC=CC=N3

InChI

InChI=1S/C20H31N5O2/c1-16(2)14-25-8-7-22-20(27)18(25)13-19(26)24-11-9-23(10-12-24)15-17-5-3-4-6-21-17/h3-6,16,18H,7-15H2,1-2H3,(H,22,27)