4-[[5-(1-methylimidazol-2-yl)pyrimidin-2-yl]amino]-2-phenylmethoxy-benzenecarbonitrile

Systemtic Name: 4-[[5-(1-methylimidazol-2-yl)pyrimidin-2-yl]amino]-2-phenylmethoxy-benzenecarbonitrile Openeye Name: 2-benzyloxy-4-[[5-(1-methylimidazol-2-yl)pyrimidin-2-yl]amino]benzonitrile CAS Name: 4-[[5-(1-methyl-2-imidazolyl)-2-pyrimidinyl]amino]-2-phenylmethoxybenzonitrile IUPAC Name: 4-[[5-(1-methylimidazol-2-yl)pyrimidin-2-yl]amino]-2-phenylmethoxybenzonitrile Traditional Name: 2-benzoxy-4-[[5-(1-methylimidazol-2-yl)pyrimidin-2-yl]amino]benzonitrile Formula: C22H18N6O MolecularWeight: 382.41792

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C2=CN=C(N=C2)NC3=CC(=C(C=C3)C#N)OCC4=CC=CC=C4

Isomeric SMILES

CN1C=CN=C1C2=CN=C(N=C2)NC3=CC(=C(C=C3)C#N)OCC4=CC=CC=C4

InChI

InChI=1S/C22H18N6O/c1-28-10-9-24-21(28)18-13-25-22(26-14-18)27-19-8-7-17(12-23)20(11-19)29-15-16-5-3-2-4-6-16/h2-11,13-14H,15H2,1H3,(H,25,26,27)