3-[[4-(2-methoxypyridin-3-yl)pyrimidin-2-yl]amino]benzenecarbonitrile

Systemtic Name: 3-[[4-(2-methoxypyridin-3-yl)pyrimidin-2-yl]amino]benzenecarbonitrile Openeye Name: 3-[[4-(2-methoxy-3-pyridyl)pyrimidin-2-yl]amino]benzonitrile CAS Name: 3-[[4-(2-methoxy-3-pyridinyl)-2-pyrimidinyl]amino]benzonitrile IUPAC Name: 3-[[4-(2-methoxypyridin-3-yl)pyrimidin-2-yl]amino]benzonitrile Traditional Name: 3-[[4-(2-methoxy-3-pyridyl)pyrimidin-2-yl]amino]benzonitrile Formula: C17H13N5O MolecularWeight: 303.31802

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC=N1)C2=NC(=NC=C2)NC3=CC=CC(=C3)C#N

Isomeric SMILES

COC1=C(C=CC=N1)C2=NC(=NC=C2)NC3=CC=CC(=C3)C#N

InChI

InChI=1S/C17H13N5O/c1-23-16-14(6-3-8-19-16)15-7-9-20-17(22-15)21-13-5-2-4-12(10-13)11-18/h2-10H,1H3,(H,20,21,22)