5-(4-methylphenyl)-[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxylate

Systemtic Name: 5-(4-methylphenyl)-[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxylate Openeye Name: 5-(p-tolyl)-[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxylate CAS Name: 5-(4-methylphenyl)-[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxylate IUPAC Name: 5-(4-methylphenyl)-[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxylate Traditional Name: 5-(p-tolyl)-[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxylate Formula: C13H9N4O2- MolecularWeight: 253.23616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=NC=NN3C(=C2)C(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=NC=NN3C(=C2)C(=O)[O-]

InChI

InChI=1S/C13H10N4O2/c1-8-2-4-9(5-3-8)10-6-11(12(18)19)17-13(16-10)14-7-15-17/h2-7H,1H3,(H,18,19)/p-1