methyl 5-tert-butyl-7-chloranyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylate

Systemtic Name: methyl 5-tert-butyl-7-chloranyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylate Openeye Name: methyl 5-tert-butyl-7-chloro-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylate CAS Name: 5-tert-butyl-7-chloro-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylic acid methyl ester IUPAC Name: methyl 5-tert-butyl-7-chloro-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylate Traditional Name: 5-tert-butyl-7-chloro-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylic acid methyl ester Formula: C11H13ClN4O2 MolecularWeight: 268.69952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC2=NC(=NN2C(=C1)Cl)C(=O)OC

Isomeric SMILES

CC(C)(C)C1=NC2=NC(=NN2C(=C1)Cl)C(=O)OC

InChI

InChI=1S/C11H13ClN4O2/c1-11(2,3)6-5-7(12)16-10(13-6)14-8(15-16)9(17)18-4/h5H,1-4H3