4-[3-(furan-2-yl)phenyl]carbonyl-1-(2-methylpropyl)-6-(pyridin-3-ylmethoxy)-1,4-diazepan-2-one

Systemtic Name: 4-[3-(furan-2-yl)phenyl]carbonyl-1-(2-methylpropyl)-6-(pyridin-3-ylmethoxy)-1,4-diazepan-2-one Openeye Name: 4-[3-(2-furyl)benzoyl]-1-isobutyl-6-(3-pyridylmethoxy)-1,4-diazepan-2-one CAS Name: 4-[[3-(2-furanyl)phenyl]-oxomethyl]-1-(2-methylpropyl)-6-(3-pyridinylmethoxy)-1,4-diazepan-2-one IUPAC Name: 4-[3-(furan-2-yl)benzoyl]-1-(2-methylpropyl)-6-(pyridin-3-ylmethoxy)-1,4-diazepan-2-one Traditional Name: 4-[3-(2-furyl)benzoyl]-1-isobutyl-6-(3-pyridylmethoxy)-1,4-diazepan-2-one Formula: C26H29N3O4 MolecularWeight: 447.52616

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1CC(CN(CC1=O)C(=O)C2=CC=CC(=C2)C3=CC=CO3)OCC4=CN=CC=C4

Isomeric SMILES

CC(C)CN1CC(CN(CC1=O)C(=O)C2=CC=CC(=C2)C3=CC=CO3)OCC4=CN=CC=C4

InChI

InChI=1S/C26H29N3O4/c1-19(2)14-28-15-23(33-18-20-6-4-10-27-13-20)16-29(17-25(28)30)26(31)22-8-3-7-21(12-22)24-9-5-11-32-24/h3-13,19,23H,14-18H2,1-2H3