IUPAC Name: | 4-(5-amino-3-tert-butylpyrazol-1-yl)benzoic acid |
Description: | 4-(5-Amino-3-tert-butyl-pyrazol-1-yl)-benzoic acid is a useful research chemical used as an intermediate in the preparation of pyrazole urea compounds useful in treatment of cancer. |
Molecular Weight: | 259.3 |
Molecular Formula: | C14H17N3O2 |
Canonical SMILES: | CC(C)(C)C1=NN(C(=C1)N)C2=CC=C(C=C2)C(=O)O |
InChI: | InChI=1S/C14H17N3O2/c1-14(2,3)11-8-12(15)17(16-11)10-6-4-9(5-7-10)13(18)19/h4-8H,15H2,1-3H3,(H,18,19) |
InChI Key: | HPBNFHMSOYVHAU-UHFFFAOYSA-N |
References: | Smith, R., et al. PCT Int. Appl. WO 2007064872, 209, (2007). |
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