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

Systemtic Name: 3-[2-(4-dimethylaminophenyl)-6-[3-(1-methyl-4,5-dihydroimidazol-2-yl)phenoxy]pyrimidin-4-yl]oxy-4-phenylmethoxy-benzenecarbonitrile Openeye Name: 4-benzyloxy-3-[2-(4-dimethylaminophenyl)-6-[3-(1-methyl-4,5-dihydroimidazol-2-yl)phenoxy]pyrimidin-4-yl]oxy-benzonitrile CAS Name: 3-[[2-(4-dimethylaminophenyl)-6-[3-(1-methyl-4,5-dihydroimidazol-2-yl)phenoxy]-4-pyrimidinyl]oxy]-4-phenylmethoxybenzonitrile IUPAC Name: 3-[2-(4-dimethylaminophenyl)-6-[3-(1-methyl-4,5-dihydroimidazol-2-yl)phenoxy]pyrimidin-4-yl]oxy-4-phenylmethoxybenzonitrile Traditional Name: 4-benzoxy-3-[2-(4-dimethylaminophenyl)-6-[3-(1-methyl-2-imidazolin-2-yl)phenoxy]pyrimidin-4-yl]oxy-benzonitrile Formula: C36H32N6O3 MolecularWeight: 596.67768

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN=C1C2=CC(=CC=C2)OC3=CC(=NC(=N3)C4=CC=C(C=C4)N(C)C)OC5=C(C=CC(=C5)C#N)OCC6=CC=CC=C6

Isomeric SMILES

CN1CCN=C1C2=CC(=CC=C2)OC3=CC(=NC(=N3)C4=CC=C(C=C4)N(C)C)OC5=C(C=CC(=C5)C#N)OCC6=CC=CC=C6

InChI

InChI=1S/C36H32N6O3/c1-41(2)29-15-13-27(14-16-29)35-39-33(44-30-11-7-10-28(21-30)36-38-18-19-42(36)3)22-34(40-35)45-32-20-26(23-37)12-17-31(32)43-24-25-8-5-4-6-9-25/h4-17,20-22H,18-19,24H2,1-3H3