3-[6-[3-(1-methyl-4,5-dihydroimidazol-2-yl)phenoxy]-2-(4-phenylphenyl)pyrimidin-4-yl]oxy-4-phenylmethoxy-benzenecarbonitrile

Systemtic Name: 3-[6-[3-(1-methyl-4,5-dihydroimidazol-2-yl)phenoxy]-2-(4-phenylphenyl)pyrimidin-4-yl]oxy-4-phenylmethoxy-benzenecarbonitrile Openeye Name: 4-benzyloxy-3-[6-[3-(1-methyl-4,5-dihydroimidazol-2-yl)phenoxy]-2-(4-phenylphenyl)pyrimidin-4-yl]oxy-benzonitrile CAS Name: 3-[[6-[3-(1-methyl-4,5-dihydroimidazol-2-yl)phenoxy]-2-(4-phenylphenyl)-4-pyrimidinyl]oxy]-4-phenylmethoxybenzonitrile IUPAC Name: 3-[6-[3-(1-methyl-4,5-dihydroimidazol-2-yl)phenoxy]-2-(4-phenylphenyl)pyrimidin-4-yl]oxy-4-phenylmethoxybenzonitrile Traditional Name: 4-benzoxy-3-[6-[3-(1-methyl-2-imidazolin-2-yl)phenoxy]-2-(4-phenylphenyl)pyrimidin-4-yl]oxy-benzonitrile Formula: C40H31N5O3 MolecularWeight: 629.70584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN=C1C2=CC(=CC=C2)OC3=CC(=NC(=N3)C4=CC=C(C=C4)C5=CC=CC=C5)OC6=C(C=CC(=C6)C#N)OCC7=CC=CC=C7

Isomeric SMILES

CN1CCN=C1C2=CC(=CC=C2)OC3=CC(=NC(=N3)C4=CC=C(C=C4)C5=CC=CC=C5)OC6=C(C=CC(=C6)C#N)OCC7=CC=CC=C7

InChI

InChI=1S/C40H31N5O3/c1-45-22-21-42-40(45)33-13-8-14-34(24-33)47-37-25-38(44-39(43-37)32-18-16-31(17-19-32)30-11-6-3-7-12-30)48-36-23-29(26-41)15-20-35(36)46-27-28-9-4-2-5-10-28/h2-20,23-25H,21-22,27H2,1H3