ethyl 5-methyl-2-propylsulfanyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate

Systemtic Name: ethyl 5-methyl-2-propylsulfanyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate Openeye Name: ethyl 5-methyl-2-propylsulfanyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate CAS Name: 5-methyl-2-(propylthio)-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-2-propylsulfanyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate Traditional Name: 5-methyl-2-(propylthio)-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylic acid ethyl ester Formula: C12H16N4O2S MolecularWeight: 280.34604

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NN2C=C(C(=NC2=N1)C)C(=O)OCC

Isomeric SMILES

CCCSC1=NN2C=C(C(=NC2=N1)C)C(=O)OCC

InChI

InChI=1S/C12H16N4O2S/c1-4-6-19-12-14-11-13-8(3)9(7-16(11)15-12)10(17)18-5-2/h7H,4-6H2,1-3H3