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

Systemtic Name: 2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(5-bromanylpyrimidin-2-yl)ethanamide Openeye Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(5-bromopyrimidin-2-yl)acetamide CAS Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-N-(5-bromo-2-pyrimidinyl)acetamide IUPAC Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(5-bromopyrimidin-2-yl)acetamide Traditional Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-N-(5-bromopyrimidin-2-yl)acetamide Formula: C8H8BrN7OS MolecularWeight: 330.16442

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=NC(=N1)NC(=O)CSC2=NNC(=N2)N)Br

Isomeric SMILES

C1=C(C=NC(=N1)NC(=O)CSC2=NNC(=N2)N)Br

InChI

InChI=1S/C8H8BrN7OS/c9-4-1-11-7(12-2-4)13-5(17)3-18-8-14-6(10)15-16-8/h1-2H,3H2,(H3,10,14,15,16)(H,11,12,13,17)