Dimethyl Sulfoxide → 5-Bromo-2-[2-(3-methoxy-2-methyl-phenyl)-ethyl]-phenylacetonitrile
Reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5]([CH2:10][CH2:11][c:12]2[c:13]([CH3:20])[c:14]([O:18][CH3:19])[cH:15][cH:16][cH:17]2)[c:6]([CH2:8][I:9])[cH:7]1.[CH3:21][S:22]([CH3:23])=[O:24].[CH:31]([OH:32])([CH3:33])[CH3:34].[Cl:28][CH2:29][Cl:30].[K:25][C:26]#[N:27]>>[Br:1][c:2]1[cH:3][cH:4][c:5]([CH2:10][CH2:11][c:12]2[c:13]([CH3:20])[c:14]([O:18][CH3:19])[cH:15][cH:16][cH:17]2)[c:6]([CH2:8][C:26]#[N:27])[cH:7]1Participants
6
Sources & evidence
- ORD record
- ord-49d772def46c4b7fb9d43a8300b6c75d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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