[4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]-(2-pyridin-2-ylquinolin-4-yl)methanone

Systemtic Name: [4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]-(2-pyridin-2-ylquinolin-4-yl)methanone Openeye Name: [4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]-[2-(2-pyridyl)-4-quinolyl]methanone CAS Name: [4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]-[2-(2-pyridinyl)-4-quinolinyl]methanone IUPAC Name: [4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]-(2-pyridin-2-ylquinolin-4-yl)methanone Traditional Name: [4-(4-fluorobenzyl)-1,4-diazepan-1-yl]-[2-(2-pyridyl)-4-quinolyl]methanone Formula: C27H25FN4O MolecularWeight: 440.512003

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=N4)CC5=CC=C(C=C5)F

Isomeric SMILES

C1CN(CCN(C1)C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=N4)CC5=CC=C(C=C5)F

InChI

InChI=1S/C27H25FN4O/c28-21-11-9-20(10-12-21)19-31-14-5-15-32(17-16-31)27(33)23-18-26(25-8-3-4-13-29-25)30-24-7-2-1-6-22(23)24/h1-4,6-13,18H,5,14-17,19H2