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

Systemtic Name: 4-[3-(furan-2-yl)-3-phenyl-propanoyl]-1-(2-methylpropyl)-6-(pyridin-3-ylmethoxy)-1,4-diazepan-2-one Openeye Name: 4-[3-(2-furyl)-3-phenyl-propanoyl]-1-isobutyl-6-(3-pyridylmethoxy)-1,4-diazepan-2-one CAS Name: 4-[3-(2-furanyl)-1-oxo-3-phenylpropyl]-1-(2-methylpropyl)-6-(3-pyridinylmethoxy)-1,4-diazepan-2-one IUPAC Name: 4-[3-(furan-2-yl)-3-phenylpropanoyl]-1-(2-methylpropyl)-6-(pyridin-3-ylmethoxy)-1,4-diazepan-2-one Traditional Name: 4-[3-(2-furyl)-3-phenyl-propanoyl]-1-isobutyl-6-(3-pyridylmethoxy)-1,4-diazepan-2-one Formula: C28H33N3O4 MolecularWeight: 475.57932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H33N3O4/c1-21(2)16-30-17-24(35-20-22-8-6-12-29-15-22)18-31(19-28(30)33)27(32)14-25(26-11-7-13-34-26)23-9-4-3-5-10-23/h3-13,15,21,24-25H,14,16-20H2,1-2H3