4-(1-benzofuran-2-ylcarbonyl)-1-[(1-methylpyrazol-4-yl)methyl]-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one

Systemtic Name: 4-(1-benzofuran-2-ylcarbonyl)-1-[(1-methylpyrazol-4-yl)methyl]-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one Openeye Name: 4-(benzofuran-2-carbonyl)-1-[(1-methylpyrazol-4-yl)methyl]-6-(4-pyridylmethoxy)-1,4-diazepan-2-one CAS Name: 4-[2-benzofuranyl(oxo)methyl]-1-[(1-methyl-4-pyrazolyl)methyl]-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one IUPAC Name: 4-(1-benzofuran-2-carbonyl)-1-[(1-methylpyrazol-4-yl)methyl]-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one Traditional Name: 4-(benzofuran-2-carbonyl)-1-[(1-methylpyrazol-4-yl)methyl]-6-(4-pyridylmethoxy)-1,4-diazepan-2-one Formula: C25H25N5O4 MolecularWeight: 459.4971

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)CN2CC(CN(CC2=O)C(=O)C3=CC4=CC=CC=C4O3)OCC5=CC=NC=C5

Isomeric SMILES

CN1C=C(C=N1)CN2CC(CN(CC2=O)C(=O)C3=CC4=CC=CC=C4O3)OCC5=CC=NC=C5

InChI

InChI=1S/C25H25N5O4/c1-28-12-19(11-27-28)13-29-14-21(33-17-18-6-8-26-9-7-18)15-30(16-24(29)31)25(32)23-10-20-4-2-3-5-22(20)34-23/h2-12,21H,13-17H2,1H3