Bromide ion → HCID 178442287, compound
Reaction equation
[Al+3:47].[Br-:46].[Br-:48].[Br-:49].[CH2:53]([Cl:54])[Cl:55].[CH3:50][S:51][CH3:52].[Cl:1][c:2]1[c:3]([F:45])[c:4]([CH:8]2[CH:9]([C:28](=[O:29])[NH:30][c:31]3[cH:32][c:33]4[cH:34][cH:35][c:36]([C:41](=[O:42])[O:43][CH3:44])[cH:37][c:38]4[cH:39][cH:40]3)[NH:10][CH:11]([CH2:23][C:24]([CH3:25])([CH3:26])[CH3:27])[C:12]2([C:13]#[N:14])[c:15]2[c:16]([F:22])[cH:17][c:18]([Cl:21])[cH:19][cH:20]2)[cH:5][cH:6][cH:7]1>>[Cl:1][c:2]1[c:3]([F:45])[c:4]([CH:8]2[CH:9]([C:28](=[O:29])[NH:30][c:31]3[cH:32][c:33]4[cH:34][cH:35][c:36]([C:41](=[O:42])[OH:43])[cH:37][c:38]4[cH:39][cH:40]3)[NH:10][CH:11]([CH2:23][C:24]([CH3:25])([CH3:26])[CH3:27])[C:12]2([C:13]#[N:14])[c:15]2[c:16]([F:22])[cH:17][c:18]([Cl:21])[cH:19][cH:20]2)[cH:5][cH:6][cH:7]1Participants
6
Sources & evidence
- ORD record
- ord-075649e243d740d18446fa389d8be84a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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