4-[(6-oxidanylidene-1H-pyridin-3-yl)carbonyl]-6-phenylmethoxy-1-(pyridin-3-ylmethyl)-1,4-diazepan-2-one

Systemtic Name: 4-[(6-oxidanylidene-1H-pyridin-3-yl)carbonyl]-6-phenylmethoxy-1-(pyridin-3-ylmethyl)-1,4-diazepan-2-one Openeye Name: 6-benzyloxy-4-(6-oxo-1H-pyridine-3-carbonyl)-1-(3-pyridylmethyl)-1,4-diazepan-2-one CAS Name: 4-[oxo-(6-oxo-1H-pyridin-3-yl)methyl]-6-phenylmethoxy-1-(3-pyridinylmethyl)-1,4-diazepan-2-one IUPAC Name: 4-(6-oxo-1H-pyridine-3-carbonyl)-6-phenylmethoxy-1-(pyridin-3-ylmethyl)-1,4-diazepan-2-one Traditional Name: 6-benzoxy-4-(6-keto-1H-pyridine-3-carbonyl)-1-(3-pyridylmethyl)-1,4-diazepan-2-one Formula: C24H24N4O4 MolecularWeight: 432.47176

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C(=O)CN1C(=O)C2=CNC(=O)C=C2)CC3=CN=CC=C3)OCC4=CC=CC=C4

Isomeric SMILES

C1C(CN(C(=O)CN1C(=O)C2=CNC(=O)C=C2)CC3=CN=CC=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C24H24N4O4/c29-22-9-8-20(12-26-22)24(31)28-15-21(32-17-18-5-2-1-3-6-18)14-27(23(30)16-28)13-19-7-4-10-25-11-19/h1-12,21H,13-17H2,(H,26,29)