ethyl 6-cyano-4-methyl-5-methylsulfanyl-7-oxidanylidene-pyrazolo[1,5-a]pyrimidine-3-carboxylate

Systemtic Name: ethyl 6-cyano-4-methyl-5-methylsulfanyl-7-oxidanylidene-pyrazolo[1,5-a]pyrimidine-3-carboxylate Openeye Name: ethyl 6-cyano-4-methyl-5-methylsulfanyl-7-oxo-pyrazolo[1,5-a]pyrimidine-3-carboxylate CAS Name: 6-cyano-4-methyl-5-(methylthio)-7-oxo-3-pyrazolo[1,5-a]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-cyano-4-methyl-5-methylsulfanyl-7-oxopyrazolo[1,5-a]pyrimidine-3-carboxylate Traditional Name: 6-cyano-7-keto-4-methyl-5-(methylthio)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid ethyl ester Formula: C12H12N4O3S MolecularWeight: 292.31368

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2N(C(=C(C(=O)N2N=C1)C#N)SC)C

Isomeric SMILES

CCOC(=O)C1=C2N(C(=C(C(=O)N2N=C1)C#N)SC)C

InChI

InChI=1S/C12H12N4O3S/c1-4-19-12(18)8-6-14-16-9(8)15(2)11(20-3)7(5-13)10(16)17/h6H,4H2,1-3H3