3-(4-fluorophenyl)-3-oxidanylidene-2-pyrimidin-4-yl-propanenitrile

Systemtic Name: 3-(4-fluorophenyl)-3-oxidanylidene-2-pyrimidin-4-yl-propanenitrile Openeye Name: 3-(4-fluorophenyl)-3-oxo-2-pyrimidin-4-yl-propanenitrile CAS Name: 3-(4-fluorophenyl)-3-oxo-2-(4-pyrimidinyl)propanenitrile IUPAC Name: 3-(4-fluorophenyl)-3-oxo-2-pyrimidin-4-ylpropanenitrile Traditional Name: 3-(4-fluorophenyl)-3-keto-2-(4-pyrimidyl)propionitrile Formula: C13H8FN3O MolecularWeight: 241.220523

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)C(C#N)C2=NC=NC=C2)F

Isomeric SMILES

C1=CC(=CC=C1C(=O)C(C#N)C2=NC=NC=C2)F

InChI

InChI=1S/C13H8FN3O/c14-10-3-1-9(2-4-10)13(18)11(7-15)12-5-6-16-8-17-12/h1-6,8,11H