Toluene → 2-Amino-3-cyano-4-methyl-5-(2,3-dihydro-2,2-dimethyl-3-benzofuranon-4yl)pyridine
Reaction equation
[CH3:12][C:13]1([CH3:27])[O:14][c:15]2[c:16]([c:19]([Sn:23]([CH3:24])([CH3:25])[CH3:26])[cH:20][cH:21][cH:22]2)[C:17]1=[O:18].[CH3:28][c:29]1[cH:30][cH:31][cH:32][cH:33][cH:34]1.[CH3:35][CH2:36][O:37][C:38](=[O:39])[CH3:40].[NH2:1][c:2]1[n:3][cH:4][c:5]([I:11])[c:6]([CH3:10])[c:7]1[C:8]#[N:9]>>[NH2:1][c:2]1[n:3][cH:4][c:5](-[c:19]2[c:16]3[c:15]([cH:22][cH:21][cH:20]2)[O:14][C:13]([CH3:12])([CH3:27])[C:17]3=[O:18])[c:6]([CH3:10])[c:7]1[C:8]#[N:9]Participants
5
Sources & evidence
- ORD record
- ord-79159b6efa63451086e19e7a06c9a358
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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