Hydrochloric Acid → 5-(3-Butyl-5-hydroxymethyl-isoxazol-4-ylmethoxy)-2-methyl-2H-pyrazole-3-carboxylic acid (2,2,2-trifluoro-ethyl)-amide
Reaction equation
[B-:23]([F:24])([F:25])([F:26])[F:27].[CH2:1]([CH2:2][CH2:3][CH3:4])[c:5]1[n:6][o:7][c:8]([CH2:21][OH:22])[c:9]1[CH2:10][O:11][c:12]1[cH:13][c:14]([C:18](=[O:19])[OH:20])[n:15]([CH3:17])[n:16]1.[CH:45]([N:46]([CH2:47][CH3:48])[CH:49]([CH3:50])[CH3:51])([CH3:52])[CH3:53].[ClH:60].[F:54][C:55]([CH2:56][NH2:57])([F:58])[F:59].[O:61]=[CH:62][N:63]([CH3:64])[CH3:65].[n:28]1([O:29][C:30]([N:31]([CH3:32])[CH3:33])=[N+:34]([CH3:35])[CH3:36])[c:37]2[cH:38][cH:39][cH:40][cH:41][c:42]2[n:43][n:44]1>>[CH2:1]([CH2:2][CH2:3][CH3:4])[c:5]1[n:6][o:7][c:8]([CH2:21][OH:22])[c:9]1[CH2:10][O:11][c:12]1[cH:13][c:14]([C:18](=[O:20])[NH:57][CH2:56][C:55]([F:54])([F:58])[F:59])[n:15]([CH3:17])[n:16]1Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-2435556caa4343048f7f383a1e6354ae
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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