2-[3-(2-chloranyl-6-fluoranyl-phenyl)piperazin-1-yl]-3-methyl-6-pyridin-4-yl-pyrimidin-4-one

Systemtic Name: 2-[3-(2-chloranyl-6-fluoranyl-phenyl)piperazin-1-yl]-3-methyl-6-pyridin-4-yl-pyrimidin-4-one Openeye Name: 2-[3-(2-chloro-6-fluoro-phenyl)piperazin-1-yl]-3-methyl-6-(4-pyridyl)pyrimidin-4-one CAS Name: 2-[3-(2-chloro-6-fluorophenyl)-1-piperazinyl]-3-methyl-6-pyridin-4-yl-4-pyrimidinone IUPAC Name: 2-[3-(2-chloro-6-fluorophenyl)piperazin-1-yl]-3-methyl-6-pyridin-4-ylpyrimidin-4-one Traditional Name: 2-[3-(2-chloro-6-fluoro-phenyl)piperazino]-3-methyl-6-(4-pyridyl)pyrimidin-4-one Formula: C20H19ClFN5O MolecularWeight: 399.849163

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C=C(N=C1N2CCNC(C2)C3=C(C=CC=C3Cl)F)C4=CC=NC=C4

Isomeric SMILES

CN1C(=O)C=C(N=C1N2CCNC(C2)C3=C(C=CC=C3Cl)F)C4=CC=NC=C4

InChI

InChI=1S/C20H19ClFN5O/c1-26-18(28)11-16(13-5-7-23-8-6-13)25-20(26)27-10-9-24-17(12-27)19-14(21)3-2-4-15(19)22/h2-8,11,17,24H,9-10,12H2,1H3