Acetic Acid → 5-(3-{[2-(tert-Butoxycarbonyl-methyl-amino)-ethylamino]-methyl}-4-fluoro-phenyl)-indazole-1-carboxylic acid tert-butyl ester
Reaction equation
[C:19]([CH3:20])([CH3:21])([CH3:22])[O:23][C:24](=[O:25])[n:26]1[n:27][cH:28][c:29]2[cH:30][c:31](-[c:35]3[cH:36][c:37]([CH:42]=[O:43])[c:38]([F:41])[cH:39][cH:40]3)[cH:32][cH:33][c:34]12.[C:1]([O:2][BH-:3]([O:4][C:5](=[O:6])[CH3:7])[O:8][C:9](=[O:10])[CH3:11])(=[O:12])[CH3:13].[C:44]([CH3:45])([CH3:46])([CH3:47])[O:48][C:49]([N:50]([CH3:51])[CH2:52][CH2:53][NH2:54])=[O:55].[CH3:15][C:16](=[O:17])[OH:18].[Cl:56][CH:57]([Cl:58])[CH3:59].[Na+:14].[OH2:60]>>[C:19]([CH3:20])([CH3:21])([CH3:22])[O:23][C:24](=[O:25])[n:26]1[n:27][cH:28][c:29]2[cH:30][c:31](-[c:35]3[cH:36][c:37]([CH2:42][NH:54][CH2:53][CH2:52][N:50]([C:49]([O:48][C:44]([CH3:45])([CH3:46])[CH3:47])=[O:55])[CH3:51])[c:38]([F:41])[cH:39][cH:40]3)[cH:32][cH:33][c:34]12Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-3ddc11d486904ea58ddd6b3407f1fe83
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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