Sodium ion → N-acetyl-N-(5-chloro-2-pyrimidinyl)-4-[5-(3,5-dichlorophenyl)-5-trifluoromethyl-4,5-dihydroisoxazole-3-yl]-2-methyl benzoic acid amide
Reaction equation
[CH3:39][C:40]([Cl:41])=[O:42].[Cl:1][c:2]1[cH:3][n:4][c:5]([NH:8][C:9]([c:10]2[c:11]([CH3:33])[cH:12][c:13]([C:16]3=[N:17][O:18][C:19]([C:21]([F:22])([F:23])[F:24])([c:25]4[cH:26][c:27]([Cl:32])[cH:28][c:29]([Cl:31])[cH:30]4)[CH2:20]3)[cH:14][cH:15]2)=[O:34])[n:6][cH:7]1.[H-:35].[H:37][H:38].[Na+:36].[O:43]1[CH2:44][CH2:45][CH2:46][CH2:47]1.[OH2:48]>>[Cl:1][c:2]1[cH:3][n:4][c:5]([N:8]([C:9]([c:10]2[c:11]([CH3:33])[cH:12][c:13]([C:16]3=[N:17][O:18][C:19]([C:21]([F:22])([F:23])[F:24])([c:25]4[cH:26][c:27]([Cl:32])[cH:28][c:29]([Cl:31])[cH:30]4)[CH2:20]3)[cH:14][cH:15]2)=[O:34])[C:40]([CH3:39])=[O:42])[n:6][cH:7]1Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-7d2a3e93c0a34254b90a3094a016e39f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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