5-azanyl-1-[6-(2-fluoranylphenoxy)pyrimidin-4-yl]-3-methyl-pyrazole-4-carbonitrile

Systemtic Name: 5-azanyl-1-[6-(2-fluoranylphenoxy)pyrimidin-4-yl]-3-methyl-pyrazole-4-carbonitrile Openeye Name: 5-amino-1-[6-(2-fluorophenoxy)pyrimidin-4-yl]-3-methyl-pyrazole-4-carbonitrile CAS Name: 5-amino-1-[6-(2-fluorophenoxy)-4-pyrimidinyl]-3-methyl-4-pyrazolecarbonitrile IUPAC Name: 5-amino-1-[6-(2-fluorophenoxy)pyrimidin-4-yl]-3-methylpyrazole-4-carbonitrile Traditional Name: 5-amino-1-[6-(2-fluorophenoxy)pyrimidin-4-yl]-3-methyl-pyrazole-4-carbonitrile Formula: C15H11FN6O MolecularWeight: 310.285843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C#N)N)C2=CC(=NC=N2)OC3=CC=CC=C3F

Isomeric SMILES

CC1=NN(C(=C1C#N)N)C2=CC(=NC=N2)OC3=CC=CC=C3F

InChI

InChI=1S/C15H11FN6O/c1-9-10(7-17)15(18)22(21-9)13-6-14(20-8-19-13)23-12-5-3-2-4-11(12)16/h2-6,8H,18H2,1H3