3-[(3-methyl-4-oxidanylidene-6-pyridin-4-yl-2H-pyrazolo[3,4-d]pyrimidin-1-yl)methyl]benzenecarbonitrile

Systemtic Name: 3-[(3-methyl-4-oxidanylidene-6-pyridin-4-yl-2H-pyrazolo[3,4-d]pyrimidin-1-yl)methyl]benzenecarbonitrile Openeye Name: 3-[[3-methyl-4-oxo-6-(4-pyridyl)-2H-pyrazolo[3,4-d]pyrimidin-1-yl]methyl]benzonitrile CAS Name: 3-[(3-methyl-4-oxo-6-pyridin-4-yl-2H-pyrazolo[3,4-d]pyrimidin-1-yl)methyl]benzonitrile IUPAC Name: 3-[(3-methyl-4-oxo-6-pyridin-4-yl-2H-pyrazolo[3,4-d]pyrimidin-1-yl)methyl]benzonitrile Traditional Name: 3-[[4-keto-3-methyl-6-(4-pyridyl)-2H-pyrazolo[3,4-d]pyrimidin-1-yl]methyl]benzonitrile Formula: C19H14N6O MolecularWeight: 342.35406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=NC(=NC2=O)C3=CC=NC=C3)N(N1)CC4=CC=CC(=C4)C#N

Isomeric SMILES

CC1=C2C(=NC(=NC2=O)C3=CC=NC=C3)N(N1)CC4=CC=CC(=C4)C#N

InChI

InChI=1S/C19H14N6O/c1-12-16-18(22-17(23-19(16)26)15-5-7-21-8-6-15)25(24-12)11-14-4-2-3-13(9-14)10-20/h2-9,24H,11H2,1H3