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

Systemtic Name: 1-[(4-methoxyphenyl)methyl]-4-(2-methylfuran-3-yl)carbonyl-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one Openeye Name: 1-[(4-methoxyphenyl)methyl]-4-(2-methylfuran-3-carbonyl)-6-(4-pyridylmethoxy)-1,4-diazepan-2-one CAS Name: 1-[(4-methoxyphenyl)methyl]-4-[(2-methyl-3-furanyl)-oxomethyl]-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one IUPAC Name: 1-[(4-methoxyphenyl)methyl]-4-(2-methylfuran-3-carbonyl)-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one Traditional Name: 4-(2-methyl-3-furoyl)-1-p-anisyl-6-(4-pyridylmethoxy)-1,4-diazepan-2-one Formula: C25H27N3O5 MolecularWeight: 449.49898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CO1)C(=O)N2CC(CN(C(=O)C2)CC3=CC=C(C=C3)OC)OCC4=CC=NC=C4

Isomeric SMILES

CC1=C(C=CO1)C(=O)N2CC(CN(C(=O)C2)CC3=CC=C(C=C3)OC)OCC4=CC=NC=C4

InChI

InChI=1S/C25H27N3O5/c1-18-23(9-12-32-18)25(30)28-15-22(33-17-20-7-10-26-11-8-20)14-27(24(29)16-28)13-19-3-5-21(31-2)6-4-19/h3-12,22H,13-17H2,1-2H3