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

Systemtic Name: 2-[3-(5-bromanylpyridin-3-yl)-1H-1,2,4-triazol-5-yl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[3-(5-bromo-3-pyridyl)-1H-1,2,4-triazol-5-yl]acetamide CAS Name: 2-[3-(5-bromo-3-pyridinyl)-1H-1,2,4-triazol-5-yl]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[3-(5-bromopyridin-3-yl)-1H-1,2,4-triazol-5-yl]acetamide Traditional Name: N-benzyl-2-[3-(5-bromo-3-pyridyl)-1H-1,2,4-triazol-5-yl]acetamide Formula: C16H14BrN5O MolecularWeight: 372.21926

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14BrN5O/c17-13-6-12(9-18-10-13)16-20-14(21-22-16)7-15(23)19-8-11-4-2-1-3-5-11/h1-6,9-10H,7-8H2,(H,19,23)(H,20,21,22)