1-[(3-bromanyl-4-fluoranyl-phenyl)methyl]-4-[(6-methylpyridin-2-yl)methyl]-1,4-diazepane

Systemtic Name: 1-[(3-bromanyl-4-fluoranyl-phenyl)methyl]-4-[(6-methylpyridin-2-yl)methyl]-1,4-diazepane Openeye Name: 1-[(3-bromo-4-fluoro-phenyl)methyl]-4-[(6-methyl-2-pyridyl)methyl]-1,4-diazepane CAS Name: 1-[(3-bromo-4-fluorophenyl)methyl]-4-[(6-methyl-2-pyridinyl)methyl]-1,4-diazepane IUPAC Name: 1-[(3-bromo-4-fluorophenyl)methyl]-4-[(6-methylpyridin-2-yl)methyl]-1,4-diazepane Traditional Name: 1-(3-bromo-4-fluoro-benzyl)-4-[(6-methyl-2-pyridyl)methyl]-1,4-diazepane Formula: C19H23BrFN3 MolecularWeight: 392.308423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)CN2CCCN(CC2)CC3=CC(=C(C=C3)F)Br

Isomeric SMILES

CC1=NC(=CC=C1)CN2CCCN(CC2)CC3=CC(=C(C=C3)F)Br

InChI

InChI=1S/C19H23BrFN3/c1-15-4-2-5-17(22-15)14-24-9-3-8-23(10-11-24)13-16-6-7-19(21)18(20)12-16/h2,4-7,12H,3,8-11,13-14H2,1H3