methyl 7-chloranyl-5-methylsulfanyl-pyrazolo[1,5-a]pyrimidine-6-carboxylate

Systemtic Name: methyl 7-chloranyl-5-methylsulfanyl-pyrazolo[1,5-a]pyrimidine-6-carboxylate Openeye Name: methyl 7-chloro-5-methylsulfanyl-pyrazolo[1,5-a]pyrimidine-6-carboxylate CAS Name: 7-chloro-5-(methylthio)-6-pyrazolo[1,5-a]pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 7-chloro-5-methylsulfanylpyrazolo[1,5-a]pyrimidine-6-carboxylate Traditional Name: 7-chloro-5-(methylthio)pyrazolo[1,5-a]pyrimidine-6-carboxylic acid methyl ester Formula: C9H8ClN3O2S MolecularWeight: 257.69672

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N2C(=CC=N2)N=C1SC)Cl

Isomeric SMILES

COC(=O)C1=C(N2C(=CC=N2)N=C1SC)Cl

InChI

InChI=1S/C9H8ClN3O2S/c1-15-9(14)6-7(10)13-5(3-4-11-13)12-8(6)16-2/h3-4H,1-2H3