Imidazole → 1,1,1-Trifluoro-2-chloro-2-(4-ethoxyphenyl)-3-(3-phenoxybenzyloxy)propane
Reaction equation
[CH3:41][C:42]#[N:43].[F:1][C:2]([C:3]([CH2:4][O:5][CH2:6][c:7]1[cH:8][c:9]([O:13][c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[cH:10][cH:11][cH:12]1)([OH:20])[c:21]1[cH:22][cH:23][c:24]([O:27][CH2:28][CH3:29])[cH:25][cH:26]1)([F:30])[F:31].[S:37]([Cl:38])([Cl:39])=[O:40].[nH:32]1[cH:33][cH:34][n:35][cH:36]1>>[F:1][C:2]([C:3]([CH2:4][O:5][CH2:6][c:7]1[cH:8][c:9]([O:13][c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[cH:10][cH:11][cH:12]1)([c:21]1[cH:22][cH:23][c:24]([O:27][CH2:28][CH3:29])[cH:25][cH:26]1)[Cl:39])([F:30])[F:31]Participants
5
Sources & evidence
- ORD record
- ord-9a78137ab5534b9fb0518ea18585565a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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