1-[(2-bromophenyl)-(5-ethylpyridin-2-yl)methyl]-1,4-diazepane

Systemtic Name: 1-[(2-bromophenyl)-(5-ethylpyridin-2-yl)methyl]-1,4-diazepane Openeye Name: 1-[(2-bromophenyl)-(5-ethyl-2-pyridyl)methyl]-1,4-diazepane CAS Name: 1-[(2-bromophenyl)-(5-ethyl-2-pyridinyl)methyl]-1,4-diazepane IUPAC Name: 1-[(2-bromophenyl)-(5-ethylpyridin-2-yl)methyl]-1,4-diazepane Traditional Name: 1-[(2-bromophenyl)-(5-ethyl-2-pyridyl)methyl]-1,4-diazepane Formula: C19H24BrN3 MolecularWeight: 374.31796

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN=C(C=C1)C(C2=CC=CC=C2Br)N3CCCNCC3

Isomeric SMILES

CCC1=CN=C(C=C1)C(C2=CC=CC=C2Br)N3CCCNCC3

InChI

InChI=1S/C19H24BrN3/c1-2-15-8-9-18(22-14-15)19(16-6-3-4-7-17(16)20)23-12-5-10-21-11-13-23/h3-4,6-9,14,19,21H,2,5,10-13H2,1H3