Bromide ion → [4-(5-Methyl-3-trifluoromethyl-1H-pyrazol-4-yl)-phenyl]-acetonitrile
Reaction equation
[Br-:10].[Br-:1].[CH2:18]([c:19]1[cH:20][cH:21][cH:22][cH:23][cH:24]1)[CH:25]([CH2:26][c:27]1[cH:28][cH:29][c:30](-[c:33]2[c:34]([C:39]([F:40])([F:41])[F:42])[n:35][nH:36][c:37]2[CH3:38])[cH:31][cH:32]1)[NH2:43].[CH2:2]([Mg+:3])[c:4]1[cH:5][cH:6][cH:7][cH:8][cH:9]1.[CH3:44][c:45]1[nH:46][n:47][c:48]([C:49]([F:50])([F:51])[F:52])[c:53]1-[c:54]1[cH:55][cH:56][c:57]([CH2:58][CH:59]([NH2:60])[c:61]2[cH:62][cH:63][cH:64][cH:65][cH:66]2)[cH:67][cH:68]1.[c:11]1([Mg+:12])[cH:13][cH:14][cH:15][cH:16][cH:17]1>>[C:25]([CH2:26][c:27]1[cH:28][cH:29][c:30](-[c:33]2[c:34]([C:39]([F:40])([F:41])[F:42])[n:35][nH:36][c:37]2[CH3:38])[cH:31][cH:32]1)#[N:43]Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-a1ed3acb824c490dbf868eb68e044ff8
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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