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

Systemtic Name: 2-[3-(6-fluoranyl-1,2-benzoxazol-3-yl)piperazin-1-yl]-3-methyl-6-pyridin-4-yl-pyrimidin-4-one Openeye Name: 2-[3-(6-fluoro-1,2-benzoxazol-3-yl)piperazin-1-yl]-3-methyl-6-(4-pyridyl)pyrimidin-4-one CAS Name: 2-[3-(6-fluoro-1,2-benzoxazol-3-yl)-1-piperazinyl]-3-methyl-6-pyridin-4-yl-4-pyrimidinone IUPAC Name: 2-[3-(6-fluoro-1,2-benzoxazol-3-yl)piperazin-1-yl]-3-methyl-6-pyridin-4-ylpyrimidin-4-one Traditional Name: 2-[3-(6-fluoroindoxazen-3-yl)piperazino]-3-methyl-6-(4-pyridyl)pyrimidin-4-one Formula: C21H19FN6O2 MolecularWeight: 406.412963

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C=C(N=C1N2CCNC(C2)C3=NOC4=C3C=CC(=C4)F)C5=CC=NC=C5

Isomeric SMILES

CN1C(=O)C=C(N=C1N2CCNC(C2)C3=NOC4=C3C=CC(=C4)F)C5=CC=NC=C5

InChI

InChI=1S/C21H19FN6O2/c1-27-19(29)11-16(13-4-6-23-7-5-13)25-21(27)28-9-8-24-17(12-28)20-15-3-2-14(22)10-18(15)30-26-20/h2-7,10-11,17,24H,8-9,12H2,1H3