N-(2,6-diethylphenyl)-2-[4-(2-phenylquinolin-4-yl)carbonyl-1,4-diazepan-1-yl]ethanamide

Systemtic Name: N-(2,6-diethylphenyl)-2-[4-(2-phenylquinolin-4-yl)carbonyl-1,4-diazepan-1-yl]ethanamide Openeye Name: N-(2,6-diethylphenyl)-2-[4-(2-phenylquinoline-4-carbonyl)-1,4-diazepan-1-yl]acetamide CAS Name: N-(2,6-diethylphenyl)-2-[4-[oxo-(2-phenyl-4-quinolinyl)methyl]-1,4-diazepan-1-yl]acetamide IUPAC Name: N-(2,6-diethylphenyl)-2-[4-(2-phenylquinoline-4-carbonyl)-1,4-diazepan-1-yl]acetamide Traditional Name: N-(2,6-diethylphenyl)-2-[4-(2-phenylquinoline-4-carbonyl)-1,4-diazepan-1-yl]acetamide Formula: C33H36N4O2 MolecularWeight: 520.66454

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)CN2CCCN(CC2)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)CN2CCCN(CC2)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C33H36N4O2/c1-3-24-14-10-15-25(4-2)32(24)35-31(38)23-36-18-11-19-37(21-20-36)33(39)28-22-30(26-12-6-5-7-13-26)34-29-17-9-8-16-27(28)29/h5-10,12-17,22H,3-4,11,18-21,23H2,1-2H3,(H,35,38)