2-methyl-5-(4-methylphenyl)-3-phenyl-pyrazolo[1,5-a]pyrimidine-7-carboxylic acid

Systemtic Name: 2-methyl-5-(4-methylphenyl)-3-phenyl-pyrazolo[1,5-a]pyrimidine-7-carboxylic acid Openeye Name: 2-methyl-3-phenyl-5-(p-tolyl)pyrazolo[1,5-a]pyrimidine-7-carboxylic acid CAS Name: 2-methyl-5-(4-methylphenyl)-3-phenyl-7-pyrazolo[1,5-a]pyrimidinecarboxylic acid IUPAC Name: 2-methyl-5-(4-methylphenyl)-3-phenylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid Traditional Name: 2-methyl-3-phenyl-5-(p-tolyl)pyrazolo[1,5-a]pyrimidine-7-carboxylic acid Formula: C21H17N3O2 MolecularWeight: 343.37858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=C(C(=NN3C(=C2)C(=O)O)C)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=C(C(=NN3C(=C2)C(=O)O)C)C4=CC=CC=C4

InChI

InChI=1S/C21H17N3O2/c1-13-8-10-15(11-9-13)17-12-18(21(25)26)24-20(22-17)19(14(2)23-24)16-6-4-3-5-7-16/h3-12H,1-2H3,(H,25,26)