6-bromanyl-2-(hydroxymethyl)-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-olate

Systemtic Name: 6-bromanyl-2-(hydroxymethyl)-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-olate Openeye Name: 6-bromo-2-(hydroxymethyl)-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-olate CAS Name: 6-bromo-2-(hydroxymethyl)-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-olate IUPAC Name: 6-bromo-2-(hydroxymethyl)-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-olate Traditional Name: 6-bromo-5-methyl-2-methylol-[1,2,4]triazolo[1,5-a]pyrimidin-7-olate Formula: C7H6BrN4O2- MolecularWeight: 258.05214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=NC(=NN2C(=C1Br)[O-])CO

Isomeric SMILES

CC1=NC2=NC(=NN2C(=C1Br)[O-])CO

InChI

InChI=1S/C7H7BrN4O2/c1-3-5(8)6(14)12-7(9-3)10-4(2-13)11-12/h13-14H,2H2,1H3/p-1