(phenylmethyl) 7-chloranyl-5-methylsulfanyl-pyrazolo[1,5-a]pyrimidine-6-carboxylate

Systemtic Name: (phenylmethyl) 7-chloranyl-5-methylsulfanyl-pyrazolo[1,5-a]pyrimidine-6-carboxylate Openeye Name: benzyl 7-chloro-5-methylsulfanyl-pyrazolo[1,5-a]pyrimidine-6-carboxylate CAS Name: 7-chloro-5-(methylthio)-6-pyrazolo[1,5-a]pyrimidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 7-chloro-5-methylsulfanylpyrazolo[1,5-a]pyrimidine-6-carboxylate Traditional Name: 7-chloro-5-(methylthio)pyrazolo[1,5-a]pyrimidine-6-carboxylic acid benzyl ester Formula: C15H12ClN3O2S MolecularWeight: 333.79268

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=CC=NN2C(=C1C(=O)OCC3=CC=CC=C3)Cl

Isomeric SMILES

CSC1=NC2=CC=NN2C(=C1C(=O)OCC3=CC=CC=C3)Cl

InChI

InChI=1S/C15H12ClN3O2S/c1-22-14-12(13(16)19-11(18-14)7-8-17-19)15(20)21-9-10-5-3-2-4-6-10/h2-8H,9H2,1H3