6-oxidanylidene-N-[4-[[4-(phenylmethyl)-1,4-diazepan-1-yl]carbonyl]phenyl]-1H-pyridine-3-carboxamide

Systemtic Name: 6-oxidanylidene-N-[4-[[4-(phenylmethyl)-1,4-diazepan-1-yl]carbonyl]phenyl]-1H-pyridine-3-carboxamide Openeye Name: N-[4-(4-benzyl-1,4-diazepane-1-carbonyl)phenyl]-6-oxo-1H-pyridine-3-carboxamide CAS Name: 6-oxo-N-[4-[oxo-[4-(phenylmethyl)-1,4-diazepan-1-yl]methyl]phenyl]-1H-pyridine-3-carboxamide IUPAC Name: N-[4-(4-benzyl-1,4-diazepane-1-carbonyl)phenyl]-6-oxo-1H-pyridine-3-carboxamide Traditional Name: N-[4-(4-benzyl-1,4-diazepane-1-carbonyl)phenyl]-6-keto-1H-pyridine-3-carboxamide Formula: C25H26N4O3 MolecularWeight: 430.49894

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)C2=CC=C(C=C2)NC(=O)C3=CNC(=O)C=C3)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN(C1)C(=O)C2=CC=C(C=C2)NC(=O)C3=CNC(=O)C=C3)CC4=CC=CC=C4

InChI

InChI=1S/C25H26N4O3/c30-23-12-9-21(17-26-23)24(31)27-22-10-7-20(8-11-22)25(32)29-14-4-13-28(15-16-29)18-19-5-2-1-3-6-19/h1-3,5-12,17H,4,13-16,18H2,(H,26,30)(H,27,31)