Bromide ion → 2-Chloro-4-fluoro-5-[4-(difluoromethyl)-4,5-dihydro-3-methyl-5-oxo-1H-1,2,4-triazol-1-yl]-benzoic Acid Methylester
Reaction equation
[Br-:30].[C:24](=[O:25])([O-:26])[O-:27].[CH3:31][CH2:32][CH2:33][CH2:34][N+:35]([CH2:36][CH2:37][CH2:38][CH3:39])([CH2:40][CH2:41][CH2:42][CH3:43])[CH2:44][CH2:45][CH2:46][CH3:47].[CH3:48][N:49]([CH3:50])[CH:51]=[O:52].[CH3:5][O:6][C:7]([c:8]1[c:9]([Cl:22])[cH:10][c:11]([F:21])[c:12](-[n:14]2[n:15][c:16]([CH3:20])[nH:17][c:18]2=[O:19])[cH:13]1)=[O:23].[Cl:1][CH:2]([F:3])[F:4].[K+:28].[K+:29]>>[CH:2]([F:3])([F:4])[n:17]1[c:16]([CH3:20])[n:15][n:14](-[c:12]2[c:11]([F:21])[cH:10][c:9]([Cl:22])[c:8]([C:7]([O:6][CH3:5])=[O:23])[cH:13]2)[c:18]1=[O:19]Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-1e930580fd684901ac1a1d6a9f215bb4
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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