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| IUPAC Name: | tert-butyl 5-amino-4-cyanopyrazole-1-carboxylate |
| Description: | 1,1-Dimethylethyl 5-Amino-4-cyano-1H-pyrazole-1-carboxylic Acid Ester is an intermediate used in the synthesis of 5-Oxo-Zaleplon (O870470), which is a metabolite of Zaleplon (Z145000), a selective non-benzodiazepine GABAA receptor agonist (1,2,3). Zaleplon is used to treat insomnia (3). |
| Molecular Weight: | 208.22 |
| Molecular Formula: | C9H12N4O2 |
| Canonical SMILES: | CC(C)(C)OC(=O)N1C(=C(C=N1)C#N)N |
| InChI: | InChI=1S/C9H12N4O2/c1-9(2,3)15-8(14)13-7(11)6(4-10)5-12-13/h5H,11H2,1-3H3 |
| InChI Key: | BAULGKJYCUDWDR-UHFFFAOYSA-N |
| Solubility: | Acetonitrile, Ethyl Acetate |
Catalog: BB054808
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