4-[[4-[[1-(phenylmethyl)imidazol-2-yl]methyl]-1,4-diazepan-1-yl]carbonyl]azetidin-2-one

Systemtic Name: 4-[[4-[[1-(phenylmethyl)imidazol-2-yl]methyl]-1,4-diazepan-1-yl]carbonyl]azetidin-2-one Openeye Name: 4-[4-[(1-benzylimidazol-2-yl)methyl]-1,4-diazepane-1-carbonyl]azetidin-2-one CAS Name: 4-[oxo-[4-[[1-(phenylmethyl)-2-imidazolyl]methyl]-1,4-diazepan-1-yl]methyl]-2-azetidinone IUPAC Name: 4-[4-[(1-benzylimidazol-2-yl)methyl]-1,4-diazepane-1-carbonyl]azetidin-2-one Traditional Name: 4-[4-[(1-benzylimidazol-2-yl)methyl]-1,4-diazepane-1-carbonyl]azetidin-2-one Formula: C20H25N5O2 MolecularWeight: 367.4448

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)C2CC(=O)N2)CC3=NC=CN3CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN(C1)C(=O)C2CC(=O)N2)CC3=NC=CN3CC4=CC=CC=C4

InChI

InChI=1S/C20H25N5O2/c26-19-13-17(22-19)20(27)24-9-4-8-23(11-12-24)15-18-21-7-10-25(18)14-16-5-2-1-3-6-16/h1-3,5-7,10,17H,4,8-9,11-15H2,(H,22,26)