3-methyl-2-[3-(phenylcarbonyl)piperidin-1-yl]-6-pyrimidin-4-yl-pyrimidin-4-one

Systemtic Name: 3-methyl-2-[3-(phenylcarbonyl)piperidin-1-yl]-6-pyrimidin-4-yl-pyrimidin-4-one Openeye Name: 2-(3-benzoyl-1-piperidyl)-3-methyl-6-pyrimidin-4-yl-pyrimidin-4-one CAS Name: 2-(3-benzoyl-1-piperidinyl)-3-methyl-6-(4-pyrimidinyl)-4-pyrimidinone IUPAC Name: 2-(3-benzoylpiperidin-1-yl)-3-methyl-6-pyrimidin-4-ylpyrimidin-4-one Traditional Name: 2-(3-benzoylpiperidino)-3-methyl-6-(4-pyrimidyl)pyrimidin-4-one Formula: C21H21N5O2 MolecularWeight: 375.42374

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C=C(N=C1N2CCCC(C2)C(=O)C3=CC=CC=C3)C4=NC=NC=C4

Isomeric SMILES

CN1C(=O)C=C(N=C1N2CCCC(C2)C(=O)C3=CC=CC=C3)C4=NC=NC=C4

InChI

InChI=1S/C21H21N5O2/c1-25-19(27)12-18(17-9-10-22-14-23-17)24-21(25)26-11-5-8-16(13-26)20(28)15-6-3-2-4-7-15/h2-4,6-7,9-10,12,14,16H,5,8,11,13H2,1H3