Bromide ion → 2-Phenylthiomethyl-4-methylsaccharin
Reaction equation
[Br-:23].[CH2:24]([N+:25]([CH2:26][CH2:27][CH2:28][CH3:29])([CH2:30][CH2:31][CH2:32][CH3:33])[CH2:34][CH2:35][CH2:36][CH3:37])[CH2:38][CH2:39][CH3:40].[CH3:1][c:2]1[c:3]2[c:9]([cH:10][cH:11][cH:12]1)[S:6](=[O:7])(=[O:8])[NH:5][C:4]2=[O:13].[CH3:41][c:42]1[cH:43][cH:44][cH:45][cH:46][cH:47]1.[CH3:48][CH2:49][O:50][C:51](=[O:52])[CH3:53].[c:14]1([S:20][CH2:21][Cl:22])[cH:15][cH:16][cH:17][cH:18][cH:19]1>>[CH3:1][c:2]1[c:3]2[c:9]([cH:10][cH:11][cH:12]1)[S:6](=[O:7])(=[O:8])[N:5]([CH2:21][S:20][c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1)[C:4]2=[O:13]Participants
7
Sources & evidence
- ORD record
- ord-dc9e1733f9be4f17a167793bf24abe2a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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