ethyl 7-methyl-2-(4-methylphenyl)sulfonyloxy-pyrazolo[1,5-a]pyrimidine-6-carboxylate

Systemtic Name: ethyl 7-methyl-2-(4-methylphenyl)sulfonyloxy-pyrazolo[1,5-a]pyrimidine-6-carboxylate Openeye Name: ethyl 7-methyl-2-(p-tolylsulfonyloxy)pyrazolo[1,5-a]pyrimidine-6-carboxylate CAS Name: 7-methyl-2-(4-methylphenyl)sulfonyloxy-6-pyrazolo[1,5-a]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 7-methyl-2-(4-methylphenyl)sulfonyloxypyrazolo[1,5-a]pyrimidine-6-carboxylate Traditional Name: 7-methyl-2-tosyloxy-pyrazolo[1,5-a]pyrimidine-6-carboxylic acid ethyl ester Formula: C17H17N3O5S MolecularWeight: 375.39898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N2C(=CC(=N2)OS(=O)(=O)C3=CC=C(C=C3)C)N=C1)C

Isomeric SMILES

CCOC(=O)C1=C(N2C(=CC(=N2)OS(=O)(=O)C3=CC=C(C=C3)C)N=C1)C

InChI

InChI=1S/C17H17N3O5S/c1-4-24-17(21)14-10-18-15-9-16(19-20(15)12(14)3)25-26(22,23)13-7-5-11(2)6-8-13/h5-10H,4H2,1-3H3