Bromide ion → Benzyl 7-(bromoacetyl)-2-oxo-2,3-dihydro-1,3-benzothiazol-4-yl carbonate
Reaction equation
[Br-:25].[Br-:26].[Br-:27].[C:1]([O:2][c:3]1[cH:4][cH:5][c:6]([C:13]([CH3:14])=[O:15])[c:7]2[c:8]1[nH:9][c:10](=[O:12])[s:11]2)([O:16][CH2:17][c:18]1[cH:19][cH:20][cH:21][cH:22][cH:23]1)=[O:24].[CH2:58]1[O:59][CH2:60][CH2:61][CH2:62]1.[OH2:63].[c:28]1([N+:29]([CH3:30])([CH3:31])[CH3:32])[cH:33][cH:34][cH:35][cH:36][cH:37]1.[c:38]1([N+:39]([CH3:40])([CH3:41])[CH3:42])[cH:43][cH:44][cH:45][cH:46][cH:47]1.[c:48]1([N+:49]([CH3:50])([CH3:51])[CH3:52])[cH:53][cH:54][cH:55][cH:56][cH:57]1>>[C:1]([O:2][c:3]1[cH:4][cH:5][c:6]([C:13]([CH2:14][Br:25])=[O:15])[c:7]2[c:8]1[nH:9][c:10](=[O:12])[s:11]2)([O:16][CH2:17][c:18]1[cH:19][cH:20][cH:21][cH:22][cH:23]1)=[O:24]Participants
6
Sources & evidence
- ORD record
- ord-4ffe641a816d43f39d241cca3fc7a19e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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