2-[4-(phenylcarbonyl)piperazin-1-yl]-6-(piperidin-1-ylmethyl)-1H-pyrimidin-4-one

Systemtic Name: 2-[4-(phenylcarbonyl)piperazin-1-yl]-6-(piperidin-1-ylmethyl)-1H-pyrimidin-4-one Openeye Name: 2-(4-benzoylpiperazin-1-yl)-6-(1-piperidylmethyl)-1H-pyrimidin-4-one CAS Name: 2-(4-benzoyl-1-piperazinyl)-6-(1-piperidinylmethyl)-1H-pyrimidin-4-one IUPAC Name: 2-(4-benzoylpiperazin-1-yl)-6-(piperidin-1-ylmethyl)-1H-pyrimidin-4-one Traditional Name: 2-(4-benzoylpiperazino)-6-(piperidinomethyl)-1H-pyrimidin-4-one Formula: C21H27N5O2 MolecularWeight: 381.47138

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC(=O)N=C(N2)N3CCN(CC3)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)CC2=CC(=O)N=C(N2)N3CCN(CC3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H27N5O2/c27-19-15-18(16-24-9-5-2-6-10-24)22-21(23-19)26-13-11-25(12-14-26)20(28)17-7-3-1-4-8-17/h1,3-4,7-8,15H,2,5-6,9-14,16H2,(H,22,23,27)