4-(4-pyrimidin-4-ylpyrazol-1-yl)benzenecarbonitrile

Systemtic Name: 4-(4-pyrimidin-4-ylpyrazol-1-yl)benzenecarbonitrile Openeye Name: 4-(4-pyrimidin-4-ylpyrazol-1-yl)benzonitrile CAS Name: 4-[4-(4-pyrimidinyl)-1-pyrazolyl]benzonitrile IUPAC Name: 4-(4-pyrimidin-4-ylpyrazol-1-yl)benzonitrile Traditional Name: 4-[4-(4-pyrimidyl)pyrazol-1-yl]benzonitrile Formula: C14H9N5 MolecularWeight: 247.25476

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)N2C=C(C=N2)C3=NC=NC=C3

Isomeric SMILES

C1=CC(=CC=C1C#N)N2C=C(C=N2)C3=NC=NC=C3

InChI

InChI=1S/C14H9N5/c15-7-11-1-3-13(4-2-11)19-9-12(8-18-19)14-5-6-16-10-17-14/h1-6,8-10H