6-[[2,6-bis(fluoranyl)phenyl]methyl]-5-methyl-2-(4-pyridin-2-ylpiperazin-1-yl)-1H-pyrimidin-4-one

Systemtic Name: 6-[[2,6-bis(fluoranyl)phenyl]methyl]-5-methyl-2-(4-pyridin-2-ylpiperazin-1-yl)-1H-pyrimidin-4-one Openeye Name: 6-[(2,6-difluorophenyl)methyl]-5-methyl-2-[4-(2-pyridyl)piperazin-1-yl]-1H-pyrimidin-4-one CAS Name: 6-[(2,6-difluorophenyl)methyl]-5-methyl-2-[4-(2-pyridinyl)-1-piperazinyl]-1H-pyrimidin-4-one IUPAC Name: 6-[(2,6-difluorophenyl)methyl]-5-methyl-2-(4-pyridin-2-ylpiperazin-1-yl)-1H-pyrimidin-4-one Traditional Name: 6-(2,6-difluorobenzyl)-5-methyl-2-[4-(2-pyridyl)piperazino]-1H-pyrimidin-4-one Formula: C21H21F2N5O MolecularWeight: 397.421146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=NC1=O)N2CCN(CC2)C3=CC=CC=N3)CC4=C(C=CC=C4F)F

Isomeric SMILES

CC1=C(NC(=NC1=O)N2CCN(CC2)C3=CC=CC=N3)CC4=C(C=CC=C4F)F

InChI

InChI=1S/C21H21F2N5O/c1-14-18(13-15-16(22)5-4-6-17(15)23)25-21(26-20(14)29)28-11-9-27(10-12-28)19-7-2-3-8-24-19/h2-8H,9-13H2,1H3,(H,25,26,29)