2-[4-(4-chlorophenyl)carbonylpiperidin-1-yl]-3-methyl-6-pyrimidin-4-yl-pyrimidin-4-one

Systemtic Name: 2-[4-(4-chlorophenyl)carbonylpiperidin-1-yl]-3-methyl-6-pyrimidin-4-yl-pyrimidin-4-one Openeye Name: 2-[4-(4-chlorobenzoyl)-1-piperidyl]-3-methyl-6-pyrimidin-4-yl-pyrimidin-4-one CAS Name: 2-[4-[(4-chlorophenyl)-oxomethyl]-1-piperidinyl]-3-methyl-6-(4-pyrimidinyl)-4-pyrimidinone IUPAC Name: 2-[4-(4-chlorobenzoyl)piperidin-1-yl]-3-methyl-6-pyrimidin-4-ylpyrimidin-4-one Traditional Name: 2-[4-(4-chlorobenzoyl)piperidino]-3-methyl-6-(4-pyrimidyl)pyrimidin-4-one Formula: C21H20ClN5O2 MolecularWeight: 409.8688

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C=C(N=C1N2CCC(CC2)C(=O)C3=CC=C(C=C3)Cl)C4=NC=NC=C4

Isomeric SMILES

CN1C(=O)C=C(N=C1N2CCC(CC2)C(=O)C3=CC=C(C=C3)Cl)C4=NC=NC=C4

InChI

InChI=1S/C21H20ClN5O2/c1-26-19(28)12-18(17-6-9-23-13-24-17)25-21(26)27-10-7-15(8-11-27)20(29)14-2-4-16(22)5-3-14/h2-6,9,12-13,15H,7-8,10-11H2,1H3