N-cyclopropyl-4-oxidanylidene-5-(4-phenylazepan-1-yl)carbonyl-1-(phenylmethyl)pyridine-3-carboxamide

Systemtic Name: N-cyclopropyl-4-oxidanylidene-5-(4-phenylazepan-1-yl)carbonyl-1-(phenylmethyl)pyridine-3-carboxamide Openeye Name: 1-benzyl-N-cyclopropyl-4-oxo-5-(4-phenylazepane-1-carbonyl)pyridine-3-carboxamide CAS Name: N-cyclopropyl-4-oxo-5-[oxo-(4-phenyl-1-azepanyl)methyl]-1-(phenylmethyl)-3-pyridinecarboxamide IUPAC Name: 1-benzyl-N-cyclopropyl-4-oxo-5-(4-phenylazepane-1-carbonyl)pyridine-3-carboxamide Traditional Name: 1-benzyl-N-cyclopropyl-4-keto-5-(4-phenylazepane-1-carbonyl)nicotinamide Formula: C29H31N3O3 MolecularWeight: 469.57474

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCN(C1)C(=O)C2=CN(C=C(C2=O)C(=O)NC3CC3)CC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CC(CCN(C1)C(=O)C2=CN(C=C(C2=O)C(=O)NC3CC3)CC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H31N3O3/c33-27-25(28(34)30-24-13-14-24)19-31(18-21-8-3-1-4-9-21)20-26(27)29(35)32-16-7-12-23(15-17-32)22-10-5-2-6-11-22/h1-6,8-11,19-20,23-24H,7,12-18H2,(H,30,34)