5,7-dimethyl-6-[(2,4,6-trimethylphenyl)methyl]pyrazolo[1,5-a]pyrimidine-3-carboxylate

Systemtic Name: 5,7-dimethyl-6-[(2,4,6-trimethylphenyl)methyl]pyrazolo[1,5-a]pyrimidine-3-carboxylate Openeye Name: 5,7-dimethyl-6-[(2,4,6-trimethylphenyl)methyl]pyrazolo[1,5-a]pyrimidine-3-carboxylate CAS Name: 5,7-dimethyl-6-[(2,4,6-trimethylphenyl)methyl]-3-pyrazolo[1,5-a]pyrimidinecarboxylate IUPAC Name: 5,7-dimethyl-6-[(2,4,6-trimethylphenyl)methyl]pyrazolo[1,5-a]pyrimidine-3-carboxylate Traditional Name: 5,7-dimethyl-6-(2,4,6-trimethylbenzyl)pyrazolo[1,5-a]pyrimidine-3-carboxylate Formula: C19H20N3O2- MolecularWeight: 322.381

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)CC2=C(N3C(=C(C=N3)C(=O)[O-])N=C2C)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)CC2=C(N3C(=C(C=N3)C(=O)[O-])N=C2C)C)C

InChI

InChI=1S/C19H21N3O2/c1-10-6-11(2)15(12(3)7-10)8-16-13(4)21-18-17(19(23)24)9-20-22(18)14(16)5/h6-7,9H,8H2,1-5H3,(H,23,24)/p-1