1-(2-methylpropyl)-6-phenylmethoxy-4-(3-pyrazin-2-ylpropanoyl)-1,4-diazepan-2-one

Systemtic Name: 1-(2-methylpropyl)-6-phenylmethoxy-4-(3-pyrazin-2-ylpropanoyl)-1,4-diazepan-2-one Openeye Name: 6-benzyloxy-1-isobutyl-4-(3-pyrazin-2-ylpropanoyl)-1,4-diazepan-2-one CAS Name: 1-(2-methylpropyl)-4-[1-oxo-3-(2-pyrazinyl)propyl]-6-phenylmethoxy-1,4-diazepan-2-one IUPAC Name: 1-(2-methylpropyl)-6-phenylmethoxy-4-(3-pyrazin-2-ylpropanoyl)-1,4-diazepan-2-one Traditional Name: 6-benzoxy-1-isobutyl-4-(3-pyrazin-2-ylpropanoyl)-1,4-diazepan-2-one Formula: C23H30N4O3 MolecularWeight: 410.5093

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1CC(CN(CC1=O)C(=O)CCC2=NC=CN=C2)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)CN1CC(CN(CC1=O)C(=O)CCC2=NC=CN=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C23H30N4O3/c1-18(2)13-26-14-21(30-17-19-6-4-3-5-7-19)15-27(16-23(26)29)22(28)9-8-20-12-24-10-11-25-20/h3-7,10-12,18,21H,8-9,13-17H2,1-2H3