(2-phenylquinolin-4-yl)-[4-(pyridin-2-ylmethyl)-1,4-diazepan-1-yl]methanone

Systemtic Name: (2-phenylquinolin-4-yl)-[4-(pyridin-2-ylmethyl)-1,4-diazepan-1-yl]methanone Openeye Name: (2-phenyl-4-quinolyl)-[4-(2-pyridylmethyl)-1,4-diazepan-1-yl]methanone CAS Name: (2-phenyl-4-quinolinyl)-[4-(2-pyridinylmethyl)-1,4-diazepan-1-yl]methanone IUPAC Name: (2-phenylquinolin-4-yl)-[4-(pyridin-2-ylmethyl)-1,4-diazepan-1-yl]methanone Traditional Name: (2-phenyl-4-quinolyl)-[4-(2-pyridylmethyl)-1,4-diazepan-1-yl]methanone Formula: C27H26N4O MolecularWeight: 422.52154

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4)CC5=CC=CC=N5

Isomeric SMILES

C1CN(CCN(C1)C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4)CC5=CC=CC=N5

InChI

InChI=1S/C27H26N4O/c32-27(31-16-8-15-30(17-18-31)20-22-11-6-7-14-28-22)24-19-26(21-9-2-1-3-10-21)29-25-13-5-4-12-23(24)25/h1-7,9-14,19H,8,15-18,20H2