2-(1,4-diazepan-1-yl)-N-(3-imidazol-1-ylpropyl)-2-oxidanylidene-ethanamide

Systemtic Name: 2-(1,4-diazepan-1-yl)-N-(3-imidazol-1-ylpropyl)-2-oxidanylidene-ethanamide Openeye Name: 2-(1,4-diazepan-1-yl)-N-(3-imidazol-1-ylpropyl)-2-oxo-acetamide CAS Name: 2-(1,4-diazepan-1-yl)-N-[3-(1-imidazolyl)propyl]-2-oxoacetamide IUPAC Name: 2-(1,4-diazepan-1-yl)-N-(3-imidazol-1-ylpropyl)-2-oxoacetamide Traditional Name: 2-(1,4-diazepan-1-yl)-N-(3-imidazol-1-ylpropyl)-2-keto-acetamide Formula: C13H21N5O2 MolecularWeight: 279.33814

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C(=O)C(=O)NCCCN2C=CN=C2

Isomeric SMILES

C1CNCCN(C1)C(=O)C(=O)NCCCN2C=CN=C2

InChI

InChI=1S/C13H21N5O2/c19-12(13(20)18-8-1-3-14-6-10-18)16-4-2-7-17-9-5-15-11-17/h5,9,11,14H,1-4,6-8,10H2,(H,16,19)