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

Systemtic Name: 2-[3-(4-fluoranyl-2-methyl-phenyl)piperazin-1-yl]-3-methyl-6-pyridin-4-yl-pyrimidin-4-one Openeye Name: 2-[3-(4-fluoro-2-methyl-phenyl)piperazin-1-yl]-3-methyl-6-(4-pyridyl)pyrimidin-4-one CAS Name: 2-[3-(4-fluoro-2-methylphenyl)-1-piperazinyl]-3-methyl-6-pyridin-4-yl-4-pyrimidinone IUPAC Name: 2-[3-(4-fluoro-2-methylphenyl)piperazin-1-yl]-3-methyl-6-pyridin-4-ylpyrimidin-4-one Traditional Name: 2-[3-(4-fluoro-2-methyl-phenyl)piperazino]-3-methyl-6-(4-pyridyl)pyrimidin-4-one Formula: C21H22FN5O MolecularWeight: 379.430683

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)F)C2CN(CCN2)C3=NC(=CC(=O)N3C)C4=CC=NC=C4

Isomeric SMILES

CC1=C(C=CC(=C1)F)C2CN(CCN2)C3=NC(=CC(=O)N3C)C4=CC=NC=C4

InChI

InChI=1S/C21H22FN5O/c1-14-11-16(22)3-4-17(14)19-13-27(10-9-24-19)21-25-18(12-20(28)26(21)2)15-5-7-23-8-6-15/h3-8,11-12,19,24H,9-10,13H2,1-2H3