Sodium ion → 6-(4-Bromo-2-chloro-phenylamino)-7-fluoro-3-methyl-3H-benzoimidazole-5-carboxylic acid (2,3-dihydroxy-propoxy)-amide
Reaction equation
[CH2:1]([CH:2]=[CH2:3])[O:4][NH:5][C:6](=[O:7])[c:8]1[cH:9][c:10]2[c:11]([n:12][cH:13][n:14]2[CH3:15])[c:16]([F:27])[c:17]1[NH:18][c:19]1[c:20]([Cl:26])[cH:21][c:22]([Br:25])[cH:23][cH:24]1.[CH3:34][N+:35]1([O-:36])[CH2:37][CH2:38][O:39][CH2:40][CH2:41]1.[CH3:47][CH2:48][O:49][C:50](=[O:51])[CH3:52].[Na+:46].[O:29]1[CH2:30][CH2:31][CH2:32][CH2:33]1.[OH2:28].[S:42](=[O:43])([OH:44])[O-:45]>>[CH2:1]([CH:2]([CH2:3][OH:29])[OH:28])[O:4][NH:5][C:6](=[O:7])[c:8]1[cH:9][c:10]2[c:11]([n:12][cH:13][n:14]2[CH3:15])[c:16]([F:27])[c:17]1[NH:18][c:19]1[c:20]([Cl:26])[cH:21][c:22]([Br:25])[cH:23][cH:24]1Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-2964ef66ec97411fb3f6b7a18adc2b3f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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