Chloride → Cyano[6-(2-fluorophenoxy)-2-pyridyl]methyl 2-(5-chloro-2-benzothienyl)-3-methylbutanoate
Reaction equation
[C:1]([CH:2]([c:3]1[cH:4][cH:5][cH:6][c:7](-[c:8]2[cH:9][cH:10][c:11]([O:12][CH3:13])[c:14]([O:15][CH3:16])[cH:17]2)[n:18]1)[OH:19])#[N:20].[C:21](#[N:22])[CH:23]([OH:24])[c:25]1[n:26][c:27]([O:31][c:32]2[c:33]([F:38])[cH:34][cH:35][cH:36][cH:37]2)[cH:28][cH:29][cH:30]1.[Cl-:39].[Cl:40][c:41]1[cH:42][cH:43][c:44]2[c:45]([cH:46][c:47]([CH:49]([C:50](=[O:51])[OH:52])[CH:53]([CH3:54])[CH3:55])[s:48]2)[cH:56]1>>[C:21](#[N:22])[CH:23]([O:24][C:50]([CH:49]([c:47]1[cH:46][c:45]2[c:44]([cH:43][cH:42][c:41]([Cl:40])[cH:56]2)[s:48]1)[CH:53]([CH3:54])[CH3:55])=[O:51])[c:25]1[n:26][c:27]([O:31][c:32]2[c:33]([F:38])[cH:34][cH:35][cH:36][cH:37]2)[cH:28][cH:29][cH:30]1Participants
5
Reactant 4
Product 1
Sources & evidence
- ORD record
- ord-729c1b620fe44907a4d85077fa4027ed
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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