Toluene → 5-fluoro-1-{3-fluoro-4-[(phenylmethyl)oxy]phenyl}-4-[(phenylmethyl)oxy]-1H-indole
Reaction equation
[Br:1][c:2]1[cH:3][c:4]([F:34])[c:5]([O:26][CH2:27][c:28]2[cH:29][cH:30][cH:31][cH:32][cH:33]2)[c:6]2[cH:7][cH:8][n:9](-[c:11]3[cH:12][c:13]([F:25])[c:14]([O:17][CH2:18][c:19]4[cH:20][cH:21][cH:22][cH:23][cH:24]4)[cH:15][cH:16]3)[c:10]12.[CH2:35]([SnH:36]([CH2:37][CH2:38][CH2:39][CH3:40])[CH2:41][CH2:42][CH2:43][CH3:44])[CH2:45][CH2:46][CH3:47].[CH3:60][c:61]1[cH:62][cH:63][cH:64][cH:65][cH:66]1.[N:48]#[C:49][C:50]([N:51]=[N:52][C:53]([C:54]#[N:55])([CH3:56])[CH3:57])([CH3:58])[CH3:59]>>[cH:2]1[cH:3][c:4]([F:34])[c:5]([O:26][CH2:27][c:28]2[cH:29][cH:30][cH:31][cH:32][cH:33]2)[c:6]2[cH:7][cH:8][n:9](-[c:11]3[cH:12][c:13]([F:25])[c:14]([O:17][CH2:18][c:19]4[cH:20][cH:21][cH:22][cH:23][cH:24]4)[cH:15][cH:16]3)[c:10]12Participants
5
Sources & evidence
- ORD record
- ord-182be467b3d14b9aa9ba8619ac6ce589
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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