Bromide ion → 4-{4-[2-(2-Benzyl-benzo[b]thiophen-3-yl)-ethyl]-phenoxysulfonyl}-2-hydroxy-benzoic acid
Reaction equation
[Br-:40].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[c:9]([CH2:17][CH2:18][c:19]2[cH:20][cH:21][c:22]([OH:25])[cH:23][cH:24]2)[c:10]2[c:11]([s:12]1)[cH:13][cH:14][cH:15][cH:16]2.[Cl:26][S:27](=[O:28])(=[O:29])[c:30]1[cH:31][c:32]([OH:39])[c:33]([C:34](=[O:35])[OH:36])[cH:37][cH:38]1.[K+:41]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[c:9]([CH2:17][CH2:18][c:19]2[cH:20][cH:21][c:22]([O:25][S:27](=[O:28])(=[O:29])[c:30]3[cH:31][c:32]([OH:39])[c:33]([C:34](=[O:35])[OH:36])[cH:37][cH:38]3)[cH:23][cH:24]2)[c:10]2[c:11]([s:12]1)[cH:13][cH:14][cH:15][cH:16]2Participants
5
Sources & evidence
- ORD record
- ord-052cf38f1342407cb04313006e28418b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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