4-[(1-methyl-6-oxidanylidene-4,5-dihydropyridazin-3-yl)carbonyl]-1-(oxan-4-ylmethyl)-6-(pyridin-3-ylmethoxy)-1,4-diazepan-2-one

Systemtic Name: 4-[(1-methyl-6-oxidanylidene-4,5-dihydropyridazin-3-yl)carbonyl]-1-(oxan-4-ylmethyl)-6-(pyridin-3-ylmethoxy)-1,4-diazepan-2-one Openeye Name: 4-(1-methyl-6-oxo-4,5-dihydropyridazine-3-carbonyl)-6-(3-pyridylmethoxy)-1-(tetrahydropyran-4-ylmethyl)-1,4-diazepan-2-one CAS Name: 4-[(1-methyl-6-oxo-4,5-dihydropyridazin-3-yl)-oxomethyl]-1-(4-oxanylmethyl)-6-(3-pyridinylmethoxy)-1,4-diazepan-2-one IUPAC Name: 4-(1-methyl-6-oxo-4,5-dihydropyridazine-3-carbonyl)-1-(oxan-4-ylmethyl)-6-(pyridin-3-ylmethoxy)-1,4-diazepan-2-one Traditional Name: 4-(6-keto-1-methyl-4,5-dihydropyridazine-3-carbonyl)-6-(3-pyridylmethoxy)-1-(tetrahydropyran-4-ylmethyl)-1,4-diazepan-2-one Formula: C23H31N5O5 MolecularWeight: 457.52274

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)CCC(=N1)C(=O)N2CC(CN(C(=O)C2)CC3CCOCC3)OCC4=CN=CC=C4

Isomeric SMILES

CN1C(=O)CCC(=N1)C(=O)N2CC(CN(C(=O)C2)CC3CCOCC3)OCC4=CN=CC=C4

InChI

InChI=1S/C23H31N5O5/c1-26-21(29)5-4-20(25-26)23(31)28-14-19(33-16-18-3-2-8-24-11-18)13-27(22(30)15-28)12-17-6-9-32-10-7-17/h2-3,8,11,17,19H,4-7,9-10,12-16H2,1H3