4-(4-fluorophenyl)-5-[2-(1-phenylethoxy)pyrimidin-4-yl]-1,2-dihydropyrazol-3-one

Systemtic Name: 4-(4-fluorophenyl)-5-[2-(1-phenylethoxy)pyrimidin-4-yl]-1,2-dihydropyrazol-3-one Openeye Name: 4-(4-fluorophenyl)-5-[2-(1-phenylethoxy)pyrimidin-4-yl]-1,2-dihydropyrazol-3-one CAS Name: 4-(4-fluorophenyl)-5-[2-(1-phenylethoxy)-4-pyrimidinyl]-1,2-dihydropyrazol-3-one IUPAC Name: 4-(4-fluorophenyl)-5-[2-(1-phenylethoxy)pyrimidin-4-yl]-1,2-dihydropyrazol-3-one Traditional Name: 4-(4-fluorophenyl)-5-[2-(1-phenylethoxy)pyrimidin-4-yl]-3-pyrazolin-3-one Formula: C21H17FN4O2 MolecularWeight: 376.383683

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)OC2=NC=CC(=N2)C3=C(C(=O)NN3)C4=CC=C(C=C4)F

Isomeric SMILES

CC(C1=CC=CC=C1)OC2=NC=CC(=N2)C3=C(C(=O)NN3)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H17FN4O2/c1-13(14-5-3-2-4-6-14)28-21-23-12-11-17(24-21)19-18(20(27)26-25-19)15-7-9-16(22)10-8-15/h2-13H,1H3,(H2,25,26,27)