Acetonitrile → 2-(1-Methylethoxy)-5-(2-thiazolyl)benzonitrile
Reaction equation
[Br:22][c:23]1[s:24][cH:25][cH:26][n:27]1.[C:28](=[O:29])([O-:30])[O-:31].[CH3:1][CH:2]([CH3:3])[O:4][c:5]1[c:6]([C:7]#[N:8])[cH:9][c:10]([B:13]2[O:14][C:15]([CH3:16])([CH3:17])[C:18]([CH3:19])([CH3:20])[O:21]2)[cH:11][cH:12]1.[CH3:34][C:35]#[N:36].[CH3:37][CH2:38][O:39][C:40](=[O:41])[CH3:42].[Cs+:32].[Cs+:33]>>[CH3:1][CH:2]([CH3:3])[O:4][c:5]1[c:6]([C:7]#[N:8])[cH:9][c:10](-[c:23]2[s:24][cH:25][cH:26][n:27]2)[cH:11][cH:12]1Participants
7
Sources & evidence
- ORD record
- ord-1ea3983f23314bcb9ce8bf640a0a6a2b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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