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

Systemtic Name: ethyl 6-cyano-5-methylsulfanyl-7-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylate Openeye Name: ethyl 6-cyano-5-methylsulfanyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylate CAS Name: 6-cyano-5-(methylthio)-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-cyano-5-methylsulfanyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylate Traditional Name: 6-cyano-7-keto-5-(methylthio)-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylic acid ethyl ester Formula: C11H10N4O3S MolecularWeight: 278.2871

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CNN2C1=NC(=C(C2=O)C#N)SC

Isomeric SMILES

CCOC(=O)C1=CNN2C1=NC(=C(C2=O)C#N)SC

InChI

InChI=1S/C11H10N4O3S/c1-3-18-11(17)7-5-13-15-8(7)14-9(19-2)6(4-12)10(15)16/h5,13H,3H2,1-2H3