Bicarbonate Ion → 3-{2-[3-Methyl-4-(2,2,2-trifluoro-ethoxy)-pyridin-2-yl-methanesulfinyl]-benzimidazole-1-sulfonyl}-4-methylbenzoic acid 2-(toluene-4-sulfonyl)ethyl ester
Reaction equation
[CH3:1][c:2]1[c:3]([CH2:14][S:15](=[O:16])[c:17]2[n:18][c:19]3[c:20]([nH:21]2)[cH:22][cH:23][cH:24][cH:25]3)[n:4][cH:5][cH:6][c:7]1[O:8][CH2:9][C:10]([F:11])([F:12])[F:13].[CH3:26][CH2:27][N:28]([CH2:29][CH3:30])[CH2:31][CH3:32].[Cl:64][CH2:65][Cl:66].[Na+:37].[O-:33][C:34]([OH:35])=[O:36].[OH2:67].[c:38]1([CH3:63])[cH:39][cH:40][c:41]([S:44](=[O:45])(=[O:46])[CH2:47][CH2:48][O:49][C:50]([c:51]2[cH:52][c:53]([S:58](=[O:59])(=[O:60])[Cl:61])[c:54]([CH3:57])[cH:55][cH:56]2)=[O:62])[cH:42][cH:43]1>>[CH3:1][c:2]1[c:3]([CH2:14][S:15](=[O:16])[c:17]2[n:18][c:19]3[c:20]([n:21]2[S:58]([c:53]2[cH:52][c:51]([C:50]([O:49][CH2:48][CH2:47][S:44]([c:41]4[cH:40][cH:39][c:38]([CH3:63])[cH:43][cH:42]4)(=[O:45])=[O:46])=[O:62])[cH:56][cH:55][c:54]2[CH3:57])(=[O:59])=[O:60])[cH:22][cH:23][cH:24][cH:25]3)[n:4][cH:5][cH:6][c:7]1[O:8][CH2:9][C:10]([F:11])([F:12])[F:13]Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-56a4402f2f334107982addb16b63d3e5
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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