3-[3-[[4-(pyridin-2-yloxymethyl)phenyl]methyl]-1,2-oxazol-5-yl]pyridin-2-amine hydrobromide

Systemtic Name: 3-[3-[[4-(pyridin-2-yloxymethyl)phenyl]methyl]-1,2-oxazol-5-yl]pyridin-2-amine hydrobromide Openeye Name: 3-[3-[[4-(2-pyridyloxymethyl)phenyl]methyl]isoxazol-5-yl]pyridin-2-amine hydrobromide CAS Name: 3-[3-[[4-(2-pyridinyloxymethyl)phenyl]methyl]-5-isoxazolyl]-2-pyridinamine hydrobromide IUPAC Name: 3-[3-[[4-(pyridin-2-yloxymethyl)phenyl]methyl]-1,2-oxazol-5-yl]pyridin-2-amine hydrobromide Traditional Name: [3-[3-[4-(2-pyridyloxymethyl)benzyl]isoxazol-5-yl]-2-pyridyl]amine hydrobromide Formula: C21H19BrN4O2 MolecularWeight: 439.30516

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)OCC2=CC=C(C=C2)CC3=NOC(=C3)C4=C(N=CC=C4)N.Br

Isomeric SMILES

C1=CC=NC(=C1)OCC2=CC=C(C=C2)CC3=NOC(=C3)C4=C(N=CC=C4)N.Br

InChI

InChI=1S/C21H18N4O2.BrH/c22-21-18(4-3-11-24-21)19-13-17(25-27-19)12-15-6-8-16(9-7-15)14-26-20-5-1-2-10-23-20;/h1-11,13H,12,14H2,(H2,22,24);1H