Hydroxide → 3-(1-{4-[3-(2,6-Dichloro-phenyl)-5-isopropyl-3H-[1,2,3]triazol-4-ylmethoxy]-2-methyl-phenyl}-ethylsulfanyl)-benzoic Acid
Reaction equation
[CH3:1][O:2][C:3]([c:4]1[cH:5][c:6]([S:10][CH:11]([CH3:12])[c:13]2[c:14]([CH3:37])[cH:15][c:16]([O:19][CH2:20][c:21]3[n:22](-[c:29]4[c:30]([Cl:36])[cH:31][cH:32][cH:33][c:34]4[Cl:35])[n:23][n:24][c:25]3[CH:26]([CH3:27])[CH3:28])[cH:17][cH:18]2)[cH:7][cH:8][cH:9]1)=[O:38].[Li+:39].[O:41]1[CH2:42][CH2:43][O:44][CH2:45][CH2:46]1.[OH-:40]>>[O:2]=[C:3]([c:4]1[cH:5][c:6]([S:10][CH:11]([CH3:12])[c:13]2[c:14]([CH3:37])[cH:15][c:16]([O:19][CH2:20][c:21]3[n:22](-[c:29]4[c:30]([Cl:36])[cH:31][cH:32][cH:33][c:34]4[Cl:35])[n:23][n:24][c:25]3[CH:26]([CH3:27])[CH3:28])[cH:17][cH:18]2)[cH:7][cH:8][cH:9]1)[OH:38]Participants
5
Reactant 4
Product 1
Sources & evidence
- ORD record
- ord-16b005e3202c4ae584193ba442041dd0
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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