(5-bromanylpyridin-3-yl)-[4-[(1-methylimidazol-2-yl)methyl]-1,4-diazepan-1-yl]methanone

Systemtic Name: (5-bromanylpyridin-3-yl)-[4-[(1-methylimidazol-2-yl)methyl]-1,4-diazepan-1-yl]methanone Openeye Name: (5-bromo-3-pyridyl)-[4-[(1-methylimidazol-2-yl)methyl]-1,4-diazepan-1-yl]methanone CAS Name: (5-bromo-3-pyridinyl)-[4-[(1-methyl-2-imidazolyl)methyl]-1,4-diazepan-1-yl]methanone IUPAC Name: (5-bromopyridin-3-yl)-[4-[(1-methylimidazol-2-yl)methyl]-1,4-diazepan-1-yl]methanone Traditional Name: (5-bromo-3-pyridyl)-[4-[(1-methylimidazol-2-yl)methyl]-1,4-diazepan-1-yl]methanone Formula: C16H20BrN5O MolecularWeight: 378.2669

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1CN2CCCN(CC2)C(=O)C3=CC(=CN=C3)Br

Isomeric SMILES

CN1C=CN=C1CN2CCCN(CC2)C(=O)C3=CC(=CN=C3)Br

InChI

InChI=1S/C16H20BrN5O/c1-20-6-3-19-15(20)12-21-4-2-5-22(8-7-21)16(23)13-9-14(17)11-18-10-13/h3,6,9-11H,2,4-5,7-8,12H2,1H3