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| IUPAC Name: | [2-(2-benzoyl-4-bromoanilino)-2-oxoethyl]-diethylazanium |
| Description: | N-Acetyl Adenine is used for switching reversibility to irreversibility in GSK-3 inhibitors and design of new compounds that are helpful in development of kinase- targeted therapies for central nervous system (CNS) diseases. |
| Molecular Weight: | 177.2 |
| Molecular Formula: | C7H7N5O |
| Canonical SMILES: | CC[NH+](CC)CC(=O)NC1=C(C=C(C=C1)Br)C(=O)C2=CC=CC=C2 |
| InChI: | InChI=1S/C19H21BrN2O2/c1-3-22(4-2)13-18(23)21-17-11-10-15(20)12-16(17)19(24)14-8-6-5-7-9-14/h5-12H,3-4,13H2,1-2H3,(H,21,23)/p+1 |
| InChI Key: | WFQXEKCFOCOXBC-UHFFFAOYSA-O |
| References: | Perez, D. I., et al. J. Med. Chem. 54, 4042 (2011). |
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