N-(4-fluorophenyl)-2-[4-(2-phenylquinolin-4-yl)carbonyl-1,4-diazepan-1-yl]ethanamide

Systemtic Name: N-(4-fluorophenyl)-2-[4-(2-phenylquinolin-4-yl)carbonyl-1,4-diazepan-1-yl]ethanamide Openeye Name: N-(4-fluorophenyl)-2-[4-(2-phenylquinoline-4-carbonyl)-1,4-diazepan-1-yl]acetamide CAS Name: N-(4-fluorophenyl)-2-[4-[oxo-(2-phenyl-4-quinolinyl)methyl]-1,4-diazepan-1-yl]acetamide IUPAC Name: N-(4-fluorophenyl)-2-[4-(2-phenylquinoline-4-carbonyl)-1,4-diazepan-1-yl]acetamide Traditional Name: N-(4-fluorophenyl)-2-[4-(2-phenylquinoline-4-carbonyl)-1,4-diazepan-1-yl]acetamide Formula: C29H27FN4O2 MolecularWeight: 482.548683

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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)CC(=O)NC5=CC=C(C=C5)F

Isomeric SMILES

C1CN(CCN(C1)C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4)CC(=O)NC5=CC=C(C=C5)F

InChI

InChI=1S/C29H27FN4O2/c30-22-11-13-23(14-12-22)31-28(35)20-33-15-6-16-34(18-17-33)29(36)25-19-27(21-7-2-1-3-8-21)32-26-10-5-4-9-24(25)26/h1-5,7-14,19H,6,15-18,20H2,(H,31,35)