3-(4-bromophenyl)-5-methyl-[1,2,4]triazolo[4,3-a]pyrimidin-7-olate

Systemtic Name: 3-(4-bromophenyl)-5-methyl-[1,2,4]triazolo[4,3-a]pyrimidin-7-olate Openeye Name: 3-(4-bromophenyl)-5-methyl-[1,2,4]triazolo[4,3-a]pyrimidin-7-olate CAS Name: 3-(4-bromophenyl)-5-methyl-[1,2,4]triazolo[4,3-a]pyrimidin-7-olate IUPAC Name: 3-(4-bromophenyl)-5-methyl-[1,2,4]triazolo[4,3-a]pyrimidin-7-olate Traditional Name: 3-(4-bromophenyl)-5-methyl-[1,2,4]triazolo[4,3-a]pyrimidin-7-olate Formula: C12H8BrN4O- MolecularWeight: 304.12212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=NN=C(N12)C3=CC=C(C=C3)Br)[O-]

Isomeric SMILES

CC1=CC(=NC2=NN=C(N12)C3=CC=C(C=C3)Br)[O-]

InChI

InChI=1S/C12H9BrN4O/c1-7-6-10(18)14-12-16-15-11(17(7)12)8-2-4-9(13)5-3-8/h2-6H,1H3,(H,14,16,18)/p-1