(5,7-dimethylpyrazolo[1,5-a]pyrimidin-2-yl) 4-methylbenzenesulfonate

Systemtic Name: (5,7-dimethylpyrazolo[1,5-a]pyrimidin-2-yl) 4-methylbenzenesulfonate Openeye Name: (5,7-dimethylpyrazolo[1,5-a]pyrimidin-2-yl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (5,7-dimethyl-2-pyrazolo[1,5-a]pyrimidinyl) ester IUPAC Name: (5,7-dimethylpyrazolo[1,5-a]pyrimidin-2-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (5,7-dimethylpyrazolo[1,5-a]pyrimidin-2-yl) ester Formula: C15H15N3O3S MolecularWeight: 317.3629

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=NN3C(=CC(=NC3=C2)C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=NN3C(=CC(=NC3=C2)C)C

InChI

InChI=1S/C15H15N3O3S/c1-10-4-6-13(7-5-10)22(19,20)21-15-9-14-16-11(2)8-12(3)18(14)17-15/h4-9H,1-3H3