2-[3-(5-bromanylpyridin-3-yl)-1H-1,2,4-triazol-5-yl]-N-[(4-methoxyphenyl)methyl]ethanamide

Systemtic Name: 2-[3-(5-bromanylpyridin-3-yl)-1H-1,2,4-triazol-5-yl]-N-[(4-methoxyphenyl)methyl]ethanamide Openeye Name: 2-[3-(5-bromo-3-pyridyl)-1H-1,2,4-triazol-5-yl]-N-[(4-methoxyphenyl)methyl]acetamide CAS Name: 2-[3-(5-bromo-3-pyridinyl)-1H-1,2,4-triazol-5-yl]-N-[(4-methoxyphenyl)methyl]acetamide IUPAC Name: 2-[3-(5-bromopyridin-3-yl)-1H-1,2,4-triazol-5-yl]-N-[(4-methoxyphenyl)methyl]acetamide Traditional Name: 2-[3-(5-bromo-3-pyridyl)-1H-1,2,4-triazol-5-yl]-N-p-anisyl-acetamide Formula: C17H16BrN5O2 MolecularWeight: 402.24524

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=O)CC2=NC(=NN2)C3=CC(=CN=C3)Br

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=O)CC2=NC(=NN2)C3=CC(=CN=C3)Br

InChI

InChI=1S/C17H16BrN5O2/c1-25-14-4-2-11(3-5-14)8-20-16(24)7-15-21-17(23-22-15)12-6-13(18)10-19-9-12/h2-6,9-10H,7-8H2,1H3,(H,20,24)(H,21,22,23)