ethyl 5-oxidanylidene-7-phenyl-6,7-dihydro-1H-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate

Systemtic Name: ethyl 5-oxidanylidene-7-phenyl-6,7-dihydro-1H-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate Openeye Name: ethyl 5-oxo-7-phenyl-6,7-dihydro-1H-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate CAS Name: 5-oxo-7-phenyl-6,7-dihydro-1H-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 5-oxo-7-phenyl-6,7-dihydro-1H-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate Traditional Name: 5-keto-7-phenyl-6,7-dihydro-1H-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylic acid ethyl ester Formula: C14H14N4O3 MolecularWeight: 286.28596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(N2C(=NC1=O)N=CN2)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1C(N2C(=NC1=O)N=CN2)C3=CC=CC=C3

InChI

InChI=1S/C14H14N4O3/c1-2-21-13(20)10-11(9-6-4-3-5-7-9)18-14(15-8-16-18)17-12(10)19/h3-8,10-11H,2H2,1H3,(H,15,16,17,19)