1-(oxan-4-ylmethyl)-6-(pyridin-3-ylmethoxy)-4-quinoxalin-5-ylcarbonyl-1,4-diazepan-2-one

Systemtic Name: 1-(oxan-4-ylmethyl)-6-(pyridin-3-ylmethoxy)-4-quinoxalin-5-ylcarbonyl-1,4-diazepan-2-one Openeye Name: 6-(3-pyridylmethoxy)-4-(quinoxaline-5-carbonyl)-1-(tetrahydropyran-4-ylmethyl)-1,4-diazepan-2-one CAS Name: 1-(4-oxanylmethyl)-4-[oxo(5-quinoxalinyl)methyl]-6-(3-pyridinylmethoxy)-1,4-diazepan-2-one IUPAC Name: 1-(oxan-4-ylmethyl)-6-(pyridin-3-ylmethoxy)-4-(quinoxaline-5-carbonyl)-1,4-diazepan-2-one Traditional Name: 6-(3-pyridylmethoxy)-4-(quinoxaline-5-carbonyl)-1-(tetrahydropyran-4-ylmethyl)-1,4-diazepan-2-one Formula: C26H29N5O4 MolecularWeight: 475.53956

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1CN2CC(CN(CC2=O)C(=O)C3=C4C(=CC=C3)N=CC=N4)OCC5=CN=CC=C5

Isomeric SMILES

C1COCCC1CN2CC(CN(CC2=O)C(=O)C3=C4C(=CC=C3)N=CC=N4)OCC5=CN=CC=C5

InChI

InChI=1S/C26H29N5O4/c32-24-17-31(26(33)22-4-1-5-23-25(22)29-10-9-28-23)16-21(35-18-20-3-2-8-27-13-20)15-30(24)14-19-6-11-34-12-7-19/h1-5,8-10,13,19,21H,6-7,11-12,14-18H2