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

Systemtic Name: N-(5-bromanylpyridin-2-yl)-2-[[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(5-bromo-2-pyridyl)-2-[(5-isobutyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-(5-bromo-2-pyridinyl)-2-[[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(5-bromopyridin-2-yl)-2-[[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(5-bromo-2-pyridyl)-2-[(5-isobutyl-1H-1,2,4-triazol-3-yl)thio]acetamide Formula: C13H16BrN5OS MolecularWeight: 370.26804

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NC(=NN1)SCC(=O)NC2=NC=C(C=C2)Br

Isomeric SMILES

CC(C)CC1=NC(=NN1)SCC(=O)NC2=NC=C(C=C2)Br

InChI

InChI=1S/C13H16BrN5OS/c1-8(2)5-11-17-13(19-18-11)21-7-12(20)16-10-4-3-9(14)6-15-10/h3-4,6,8H,5,7H2,1-2H3,(H,15,16,20)(H,17,18,19)