5-[(4-fluorophenyl)methoxy]-2-(4-pyrimidin-2-ylpiperazin-1-yl)carbonyl-pyran-4-one

Systemtic Name: 5-[(4-fluorophenyl)methoxy]-2-(4-pyrimidin-2-ylpiperazin-1-yl)carbonyl-pyran-4-one Openeye Name: 5-[(4-fluorophenyl)methoxy]-2-(4-pyrimidin-2-ylpiperazine-1-carbonyl)pyran-4-one CAS Name: 5-[(4-fluorophenyl)methoxy]-2-[oxo-[4-(2-pyrimidinyl)-1-piperazinyl]methyl]-4-pyranone IUPAC Name: 5-[(4-fluorophenyl)methoxy]-2-(4-pyrimidin-2-ylpiperazine-1-carbonyl)pyran-4-one Traditional Name: 5-(4-fluorobenzyl)oxy-2-[4-(2-pyrimidyl)piperazine-1-carbonyl]pyran-4-one Formula: C21H19FN4O4 MolecularWeight: 410.398363

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)C3=CC(=O)C(=CO3)OCC4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)C3=CC(=O)C(=CO3)OCC4=CC=C(C=C4)F

InChI

InChI=1S/C21H19FN4O4/c22-16-4-2-15(3-5-16)13-29-19-14-30-18(12-17(19)27)20(28)25-8-10-26(11-9-25)21-23-6-1-7-24-21/h1-7,12,14H,8-11,13H2