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

Systemtic Name: ethyl 2-methylsulfanyl-7-oxidanylidene-1H-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate Openeye Name: ethyl 2-methylsulfanyl-7-oxo-1H-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate CAS Name: 2-(methylthio)-7-oxo-1H-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-methylsulfanyl-7-oxo-1H-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate Traditional Name: 7-keto-2-(methylthio)-1H-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylic acid ethyl ester Formula: C9H10N4O3S MolecularWeight: 254.2657

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2N=C(NN2C1=O)SC

Isomeric SMILES

CCOC(=O)C1=CN=C2N=C(NN2C1=O)SC

InChI

InChI=1S/C9H10N4O3S/c1-3-16-7(15)5-4-10-8-11-9(17-2)12-13(8)6(5)14/h4H,3H2,1-2H3,(H,10,11,12)