4-[[5-[[4-(3-methoxyquinolin-4-yl)carbonylpiperazin-1-yl]methyl]imidazol-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[5-[[4-(3-methoxyquinolin-4-yl)carbonylpiperazin-1-yl]methyl]imidazol-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[5-[[4-(3-methoxyquinoline-4-carbonyl)piperazin-1-yl]methyl]imidazol-1-yl]methyl]benzonitrile CAS Name: 4-[[5-[[4-[(3-methoxy-4-quinolinyl)-oxomethyl]-1-piperazinyl]methyl]-1-imidazolyl]methyl]benzonitrile IUPAC Name: 4-[[5-[[4-(3-methoxyquinoline-4-carbonyl)piperazin-1-yl]methyl]imidazol-1-yl]methyl]benzonitrile Traditional Name: 4-[[5-[[4-(3-methoxyquinoline-4-carbonyl)piperazino]methyl]imidazol-1-yl]methyl]benzonitrile Formula: C27H26N6O2 MolecularWeight: 466.53434

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=CC=CC=C2N=C1)C(=O)N3CCN(CC3)CC4=CN=CN4CC5=CC=C(C=C5)C#N

Isomeric SMILES

COC1=C(C2=CC=CC=C2N=C1)C(=O)N3CCN(CC3)CC4=CN=CN4CC5=CC=C(C=C5)C#N

InChI

InChI=1S/C27H26N6O2/c1-35-25-16-30-24-5-3-2-4-23(24)26(25)27(34)32-12-10-31(11-13-32)18-22-15-29-19-33(22)17-21-8-6-20(14-28)7-9-21/h2-9,15-16,19H,10-13,17-18H2,1H3