3-methylbutyl 6-methanoyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylate

Systemtic Name: 3-methylbutyl 6-methanoyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylate Openeye Name: isopentyl 6-formyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylate CAS Name: 6-formyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 6-formyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylate Traditional Name: 6-formyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylic acid isoamyl ester Formula: C12H14N4O3 MolecularWeight: 262.26456

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC(=O)C1=NN2C=C(C=NC2=N1)C=O

Isomeric SMILES

CC(C)CCOC(=O)C1=NN2C=C(C=NC2=N1)C=O

InChI

InChI=1S/C12H14N4O3/c1-8(2)3-4-19-11(18)10-14-12-13-5-9(7-17)6-16(12)15-10/h5-8H,3-4H2,1-2H3