(3-bromanyl-2-fluoranyl-phenyl)-[4-[(1-methylimidazol-2-yl)methyl]-1,4-diazepan-1-yl]methanone

Systemtic Name: (3-bromanyl-2-fluoranyl-phenyl)-[4-[(1-methylimidazol-2-yl)methyl]-1,4-diazepan-1-yl]methanone Openeye Name: (3-bromo-2-fluoro-phenyl)-[4-[(1-methylimidazol-2-yl)methyl]-1,4-diazepan-1-yl]methanone CAS Name: (3-bromo-2-fluorophenyl)-[4-[(1-methyl-2-imidazolyl)methyl]-1,4-diazepan-1-yl]methanone IUPAC Name: (3-bromo-2-fluorophenyl)-[4-[(1-methylimidazol-2-yl)methyl]-1,4-diazepan-1-yl]methanone Traditional Name: (3-bromo-2-fluoro-phenyl)-[4-[(1-methylimidazol-2-yl)methyl]-1,4-diazepan-1-yl]methanone Formula: C17H20BrFN4O MolecularWeight: 395.269303

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20BrFN4O/c1-21-9-6-20-15(21)12-22-7-3-8-23(11-10-22)17(24)13-4-2-5-14(18)16(13)19/h2,4-6,9H,3,7-8,10-12H2,1H3