1-[(4-methoxyphenyl)methyl]-4-(2-methylpyrazol-3-yl)carbonyl-6-(pyridin-3-ylmethoxy)-1,4-diazepan-2-one

Systemtic Name: 1-[(4-methoxyphenyl)methyl]-4-(2-methylpyrazol-3-yl)carbonyl-6-(pyridin-3-ylmethoxy)-1,4-diazepan-2-one Openeye Name: 1-[(4-methoxyphenyl)methyl]-4-(2-methylpyrazole-3-carbonyl)-6-(3-pyridylmethoxy)-1,4-diazepan-2-one CAS Name: 1-[(4-methoxyphenyl)methyl]-4-[(2-methyl-3-pyrazolyl)-oxomethyl]-6-(3-pyridinylmethoxy)-1,4-diazepan-2-one IUPAC Name: 1-[(4-methoxyphenyl)methyl]-4-(2-methylpyrazole-3-carbonyl)-6-(pyridin-3-ylmethoxy)-1,4-diazepan-2-one Traditional Name: 4-(2-methylpyrazole-3-carbonyl)-1-p-anisyl-6-(3-pyridylmethoxy)-1,4-diazepan-2-one Formula: C24H27N5O4 MolecularWeight: 449.50228

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=N1)C(=O)N2CC(CN(C(=O)C2)CC3=CC=C(C=C3)OC)OCC4=CN=CC=C4

Isomeric SMILES

CN1C(=CC=N1)C(=O)N2CC(CN(C(=O)C2)CC3=CC=C(C=C3)OC)OCC4=CN=CC=C4

InChI

InChI=1S/C24H27N5O4/c1-27-22(9-11-26-27)24(31)29-15-21(33-17-19-4-3-10-25-12-19)14-28(23(30)16-29)13-18-5-7-20(32-2)8-6-18/h3-12,21H,13-17H2,1-2H3