6-(2-fluorophenyl)-2-[4-(2-hydroxyethyl)-3-methyl-5-oxidanidyl-pyrazol-1-yl]pyrimidin-4-olate

Systemtic Name: 6-(2-fluorophenyl)-2-[4-(2-hydroxyethyl)-3-methyl-5-oxidanidyl-pyrazol-1-yl]pyrimidin-4-olate Openeye Name: 6-(2-fluorophenyl)-2-[4-(2-hydroxyethyl)-3-methyl-5-oxido-pyrazol-1-yl]pyrimidin-4-olate CAS Name: 6-(2-fluorophenyl)-2-[4-(2-hydroxyethyl)-3-methyl-5-oxido-1-pyrazolyl]-4-pyrimidinolate IUPAC Name: 6-(2-fluorophenyl)-2-[4-(2-hydroxyethyl)-3-methyl-5-oxidopyrazol-1-yl]pyrimidin-4-olate Traditional Name: 6-(2-fluorophenyl)-2-[4-(2-hydroxyethyl)-3-methyl-5-oxido-pyrazol-1-yl]pyrimidin-4-olate Formula: C16H13FN4O3-2 MolecularWeight: 328.297823

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1CCO)[O-])C2=NC(=CC(=N2)[O-])C3=CC=CC=C3F

Isomeric SMILES

CC1=NN(C(=C1CCO)[O-])C2=NC(=CC(=N2)[O-])C3=CC=CC=C3F

InChI

InChI=1S/C16H15FN4O3/c1-9-10(6-7-22)15(24)21(20-9)16-18-13(8-14(23)19-16)11-4-2-3-5-12(11)17/h2-5,8,22,24H,6-7H2,1H3,(H,18,19,23)/p-2