Carbon Tetrachloride → 3-{[3-(Bromomethyl)-2,6-difluorophenyl]oxy}-5-chlorobenzonitrile
Reaction equation
[C:40]([Cl:41])([Cl:42])([Cl:43])[Cl:44].[Cl:1][c:2]1[cH:3][c:4]([C:5]#[N:6])[cH:7][c:8]([O:10][c:11]2[c:12]([F:19])[c:13]([CH3:18])[cH:14][cH:15][c:16]2[F:17])[cH:9]1.[N:28]#[C:29][C:30]([N:31]=[N:32][C:33]([C:34]#[N:35])([CH3:36])[CH3:37])([CH3:38])[CH3:39].[O:20]=[C:21]1[N:22]([Br:27])[C:23](=[O:24])[CH2:25][CH2:26]1>>[Cl:1][c:2]1[cH:3][c:4]([C:5]#[N:6])[cH:7][c:8]([O:10][c:11]2[c:12]([F:19])[c:13]([CH2:18][Br:27])[cH:14][cH:15][c:16]2[F:17])[cH:9]1Participants
5
Sources & evidence
- ORD record
- ord-470038aef1f34be39d58c4a6f1a06b6c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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