3-[3-[(2-azanyl-1-methyl-6-oxidanylidene-pyrimidin-4-yl)methyl]phenyl]benzenecarbonitrile

Systemtic Name: 3-[3-[(2-azanyl-1-methyl-6-oxidanylidene-pyrimidin-4-yl)methyl]phenyl]benzenecarbonitrile Openeye Name: 3-[3-[(2-amino-1-methyl-6-oxo-pyrimidin-4-yl)methyl]phenyl]benzonitrile CAS Name: 3-[3-[(2-amino-1-methyl-6-oxo-4-pyrimidinyl)methyl]phenyl]benzonitrile IUPAC Name: 3-[3-[(2-amino-1-methyl-6-oxopyrimidin-4-yl)methyl]phenyl]benzonitrile Traditional Name: 3-[3-[(2-amino-6-keto-1-methyl-pyrimidin-4-yl)methyl]phenyl]benzonitrile Formula: C19H16N4O MolecularWeight: 316.35654

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C=C(N=C1N)CC2=CC=CC(=C2)C3=CC=CC(=C3)C#N

Isomeric SMILES

CN1C(=O)C=C(N=C1N)CC2=CC=CC(=C2)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C19H16N4O/c1-23-18(24)11-17(22-19(23)21)10-13-4-2-6-15(8-13)16-7-3-5-14(9-16)12-20/h2-9,11H,10H2,1H3,(H2,21,22)