4-[(4-cyanophenyl)methoxy-(3-methylimidazol-4-yl)methyl]-2-quinolin-8-yl-benzenecarbonitrile

Systemtic Name: 4-[(4-cyanophenyl)methoxy-(3-methylimidazol-4-yl)methyl]-2-quinolin-8-yl-benzenecarbonitrile Openeye Name: 4-[(4-cyanophenyl)methoxy-(3-methylimidazol-4-yl)methyl]-2-(8-quinolyl)benzonitrile CAS Name: 4-[(4-cyanophenyl)methoxy-(3-methyl-4-imidazolyl)methyl]-2-(8-quinolinyl)benzonitrile IUPAC Name: 4-[(4-cyanophenyl)methoxy-(3-methylimidazol-4-yl)methyl]-2-quinolin-8-ylbenzonitrile Traditional Name: 4-[(4-cyanobenzyl)oxy-(3-methylimidazol-4-yl)methyl]-2-(8-quinolyl)benzonitrile Formula: C29H21N5O MolecularWeight: 455.50994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC=C1C(C2=CC(=C(C=C2)C#N)C3=CC=CC4=C3N=CC=C4)OCC5=CC=C(C=C5)C#N

Isomeric SMILES

CN1C=NC=C1C(C2=CC(=C(C=C2)C#N)C3=CC=CC4=C3N=CC=C4)OCC5=CC=C(C=C5)C#N

InChI

InChI=1S/C29H21N5O/c1-34-19-32-17-27(34)29(35-18-21-9-7-20(15-30)8-10-21)23-11-12-24(16-31)26(14-23)25-6-2-4-22-5-3-13-33-28(22)25/h2-14,17,19,29H,18H2,1H3