Acetic Acid → 2-(4-Chloro-2,6-dimethyl-phenoxy)N4-(1-ethyl-propyl)-6-methyl-pyridine-3,4-diamine
Reaction equation
[C:27]([OH:28])(=[O:29])[CH3:30].[CH2:1]([CH3:2])[CH:3]([CH2:4][CH3:5])[NH:6][c:7]1[c:8]([N+:24]([O-:25])=[O:26])[c:9]([O:14][c:15]2[c:16]([CH3:23])[cH:17][c:18]([Cl:22])[cH:19][c:20]2[CH3:21])[n:10][c:11]([CH3:13])[cH:12]1.[Fe:32].[OH2:31]>>[CH2:1]([CH3:2])[CH:3]([CH2:4][CH3:5])[NH:6][c:7]1[c:8]([NH2:24])[c:9]([O:14][c:15]2[c:16]([CH3:23])[cH:17][c:18]([Cl:22])[cH:19][c:20]2[CH3:21])[n:10][c:11]([CH3:13])[cH:12]1Participants
5
Sources & evidence
- ORD record
- ord-492fab1e38fe49c29078bb6f820dd833
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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