N3-[[5-bromanyl-2-(pyridin-3-ylmethoxy)phenyl]methyl]pyridine-2,3-diamine

Systemtic Name: N3-[[5-bromanyl-2-(pyridin-3-ylmethoxy)phenyl]methyl]pyridine-2,3-diamine Openeye Name: N3-[[5-bromo-2-(3-pyridylmethoxy)phenyl]methyl]pyridine-2,3-diamine CAS Name: N3-[[5-bromo-2-(3-pyridinylmethoxy)phenyl]methyl]pyridine-2,3-diamine IUPAC Name: 3-N-[[5-bromo-2-(pyridin-3-ylmethoxy)phenyl]methyl]pyridine-2,3-diamine Traditional Name: (2-amino-3-pyridyl)-[5-bromo-2-(3-pyridylmethoxy)benzyl]amine Formula: C18H17BrN4O MolecularWeight: 385.25778

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)COC2=C(C=C(C=C2)Br)CNC3=C(N=CC=C3)N

Isomeric SMILES

C1=CC(=CN=C1)COC2=C(C=C(C=C2)Br)CNC3=C(N=CC=C3)N

InChI

InChI=1S/C18H17BrN4O/c19-15-5-6-17(24-12-13-3-1-7-21-10-13)14(9-15)11-23-16-4-2-8-22-18(16)20/h1-10,23H,11-12H2,(H2,20,22)