Benzene → 5-{4-(3-chloro-5-trifluoromethylpyridin-2-yloxy)-alpha-fluorobenzyl}-3-(2-chloro-6-fluorophenyl)-1 methyl-1H-1,2,4-triazole
Reaction equation
[CH2:35]([N:36]([S:37]([F:38])([F:39])[F:41])[CH2:40][CH3:42])[CH3:43].[Cl:1][c:2]1[c:3]([O:12][c:13]2[cH:14][cH:15][c:16]([CH:17]([OH:18])[c:19]3[n:20][c:21](-[c:25]4[c:26]([Cl:32])[cH:27][cH:28][cH:29][c:30]4[F:31])[n:22][n:23]3[CH3:24])[cH:33][cH:34]2)[n:4][cH:5][c:6]([C:8]([F:9])([F:10])[F:11])[cH:7]1.[OH2:44].[cH:45]1[cH:46][cH:47][cH:48][cH:49][cH:50]1>>[Cl:1][c:2]1[c:3]([O:12][c:13]2[cH:14][cH:15][c:16]([CH:17]([c:19]3[n:20][c:21](-[c:25]4[c:26]([Cl:32])[cH:27][cH:28][cH:29][c:30]4[F:31])[n:22][n:23]3[CH3:24])[F:41])[cH:33][cH:34]2)[n:4][cH:5][c:6]([C:8]([F:9])([F:10])[F:11])[cH:7]1Participants
5
Sources & evidence
- ORD record
- ord-e5807e5bf766401d8ade9b74211759e9
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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