methyl 5,7-diphenyl-[1,2,4]triazolo[4,3-a]pyrimidine-3-carboxylate

Systemtic Name: methyl 5,7-diphenyl-[1,2,4]triazolo[4,3-a]pyrimidine-3-carboxylate Openeye Name: methyl 5,7-diphenyl-[1,2,4]triazolo[4,3-a]pyrimidine-3-carboxylate CAS Name: 5,7-diphenyl-[1,2,4]triazolo[4,3-a]pyrimidine-3-carboxylic acid methyl ester IUPAC Name: methyl 5,7-diphenyl-[1,2,4]triazolo[4,3-a]pyrimidine-3-carboxylate Traditional Name: 5,7-diphenyl-[1,2,4]triazolo[4,3-a]pyrimidine-3-carboxylic acid methyl ester Formula: C19H14N4O2 MolecularWeight: 330.34006

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NN=C2N1C(=CC(=N2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=NN=C2N1C(=CC(=N2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C19H14N4O2/c1-25-18(24)17-21-22-19-20-15(13-8-4-2-5-9-13)12-16(23(17)19)14-10-6-3-7-11-14/h2-12H,1H3