Water → 4-[2-(2,4-dichlorophenyl)-5-methyl-4-({[5-(trifluoromethyl)pyridin-2-yl]amino}carbonyl)-1H-imidazol-1-yl]phenyl 3,3,3-trifluoropropane-1-sulfonate
Reaction equation
[CH3:35][CH2:36][N:37]([CH2:38][CH3:39])[CH2:40][CH3:41].[Cl:1][c:2]1[c:3](-[c:9]2[n:10](-[c:28]3[cH:29][cH:30][c:31]([OH:34])[cH:32][cH:33]3)[c:11]([CH3:27])[c:12]([C:14](=[O:15])[NH:16][c:17]3[n:18][cH:19][c:20]([C:23]([F:24])([F:25])[F:26])[cH:21][cH:22]3)[n:13]2)[cH:4][cH:5][c:6]([Cl:8])[cH:7]1.[Cl:53][CH2:54][Cl:55].[F:42][C:43]([CH2:44][CH2:45][S:46](=[O:47])(=[O:48])[Cl:49])([F:50])[F:51].[OH2:52]>>[Cl:1][c:2]1[c:3](-[c:9]2[n:10](-[c:28]3[cH:29][cH:30][c:31]([O:34][S:46]([CH2:45][CH2:44][C:43]([F:42])([F:50])[F:51])(=[O:47])=[O:48])[cH:32][cH:33]3)[c:11]([CH3:27])[c:12]([C:14](=[O:15])[NH:16][c:17]3[n:18][cH:19][c:20]([C:23]([F:24])([F:25])[F:26])[cH:21][cH:22]3)[n:13]2)[cH:4][cH:5][c:6]([Cl:8])[cH:7]1Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-1b63edd7db89427497d93c3d2feccaa7
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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