4-[(2S)-5-oxidanylidenepyrrolidin-2-yl]carbonyl-1-(phenylmethyl)-6-(pyridin-3-ylmethoxy)-1,4-diazepan-2-one

Systemtic Name: 4-[(2S)-5-oxidanylidenepyrrolidin-2-yl]carbonyl-1-(phenylmethyl)-6-(pyridin-3-ylmethoxy)-1,4-diazepan-2-one Openeye Name: 1-benzyl-4-[(2S)-5-oxopyrrolidine-2-carbonyl]-6-(3-pyridylmethoxy)-1,4-diazepan-2-one CAS Name: 4-[oxo-[(2S)-5-oxo-2-pyrrolidinyl]methyl]-1-(phenylmethyl)-6-(3-pyridinylmethoxy)-1,4-diazepan-2-one IUPAC Name: 1-benzyl-4-[(2S)-5-oxopyrrolidine-2-carbonyl]-6-(pyridin-3-ylmethoxy)-1,4-diazepan-2-one Traditional Name: 1-benzyl-4-[(2S)-5-ketoprolyl]-6-(3-pyridylmethoxy)-1,4-diazepan-2-one Formula: C23H26N4O4 MolecularWeight: 422.47694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)NC1C(=O)N2CC(CN(C(=O)C2)CC3=CC=CC=C3)OCC4=CN=CC=C4

Isomeric SMILES

C1CC(=O)N[C@@H]1C(=O)N2CC(CN(C(=O)C2)CC3=CC=CC=C3)OCC4=CN=CC=C4

InChI

InChI=1S/C23H26N4O4/c28-21-9-8-20(25-21)23(30)27-14-19(31-16-18-7-4-10-24-11-18)13-26(22(29)15-27)12-17-5-2-1-3-6-17/h1-7,10-11,19-20H,8-9,12-16H2,(H,25,28)/t19?,20-/m0/s1