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

Systemtic Name: 2-[[4-azanyl-5-(5-methyl-1H-pyrazol-3-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(5-bromanylpyridin-2-yl)ethanamide Openeye Name: 2-[[4-amino-5-(5-methyl-1H-pyrazol-3-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(5-bromo-2-pyridyl)acetamide CAS Name: 2-[[4-amino-5-(5-methyl-1H-pyrazol-3-yl)-1,2,4-triazol-3-yl]thio]-N-(5-bromo-2-pyridinyl)acetamide IUPAC Name: 2-[[4-amino-5-(5-methyl-1H-pyrazol-3-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(5-bromopyridin-2-yl)acetamide Traditional Name: 2-[[4-amino-5-(5-methyl-1H-pyrazol-3-yl)-1,2,4-triazol-3-yl]thio]-N-(5-bromo-2-pyridyl)acetamide Formula: C13H13BrN8OS MolecularWeight: 409.26432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1)C2=NN=C(N2N)SCC(=O)NC3=NC=C(C=C3)Br

Isomeric SMILES

CC1=CC(=NN1)C2=NN=C(N2N)SCC(=O)NC3=NC=C(C=C3)Br

InChI

InChI=1S/C13H13BrN8OS/c1-7-4-9(19-18-7)12-20-21-13(22(12)15)24-6-11(23)17-10-3-2-8(14)5-16-10/h2-5H,6,15H2,1H3,(H,18,19)(H,16,17,23)