methyl 5-azanyl-1-[6-(4-fluoranylphenoxy)pyrimidin-4-yl]pyrazole-4-carboxylate

Systemtic Name: methyl 5-azanyl-1-[6-(4-fluoranylphenoxy)pyrimidin-4-yl]pyrazole-4-carboxylate Openeye Name: methyl 5-amino-1-[6-(4-fluorophenoxy)pyrimidin-4-yl]pyrazole-4-carboxylate CAS Name: 5-amino-1-[6-(4-fluorophenoxy)-4-pyrimidinyl]-4-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 5-amino-1-[6-(4-fluorophenoxy)pyrimidin-4-yl]pyrazole-4-carboxylate Traditional Name: 5-amino-1-[6-(4-fluorophenoxy)pyrimidin-4-yl]pyrazole-4-carboxylic acid methyl ester Formula: C15H12FN5O3 MolecularWeight: 329.285883

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N(N=C1)C2=CC(=NC=N2)OC3=CC=C(C=C3)F)N

Isomeric SMILES

COC(=O)C1=C(N(N=C1)C2=CC(=NC=N2)OC3=CC=C(C=C3)F)N

InChI

InChI=1S/C15H12FN5O3/c1-23-15(22)11-7-20-21(14(11)17)12-6-13(19-8-18-12)24-10-4-2-9(16)3-5-10/h2-8H,17H2,1H3