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

Systemtic Name: 5-azanyl-3-ethyl-1-[6-(4-fluoranylphenoxy)pyrimidin-4-yl]pyrazole-4-carbonitrile Openeye Name: 5-amino-3-ethyl-1-[6-(4-fluorophenoxy)pyrimidin-4-yl]pyrazole-4-carbonitrile CAS Name: 5-amino-3-ethyl-1-[6-(4-fluorophenoxy)-4-pyrimidinyl]-4-pyrazolecarbonitrile IUPAC Name: 5-amino-3-ethyl-1-[6-(4-fluorophenoxy)pyrimidin-4-yl]pyrazole-4-carbonitrile Traditional Name: 5-amino-3-ethyl-1-[6-(4-fluorophenoxy)pyrimidin-4-yl]pyrazole-4-carbonitrile Formula: C16H13FN6O MolecularWeight: 324.312423

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=C1C#N)N)C2=CC(=NC=N2)OC3=CC=C(C=C3)F

Isomeric SMILES

CCC1=NN(C(=C1C#N)N)C2=CC(=NC=N2)OC3=CC=C(C=C3)F

InChI

InChI=1S/C16H13FN6O/c1-2-13-12(8-18)16(19)23(22-13)14-7-15(21-9-20-14)24-11-5-3-10(17)4-6-11/h3-7,9H,2,19H2,1H3