Acetic Acid → 3'-(Ethylsulfonyl)-2-(2-fluoro-5-methylpyridin-3-yl)-4-methyl-5-(trifluoromethyl)biphenyl-3-amine
Reaction equation
[C:34]([OH:35])(=[O:36])[CH3:37].[CH2:1]([CH3:2])[S:3](=[O:4])(=[O:5])[c:6]1[cH:7][c:8](-[c:12]2[c:13](-[c:26]3[c:27]([F:33])[n:28][cH:29][c:30]([CH3:32])[cH:31]3)[c:14]([N+:23]([O-:24])=[O:25])[c:15]([CH3:22])[c:16]([C:18]([F:19])([F:20])[F:21])[cH:17]2)[cH:9][cH:10][cH:11]1.[Fe:38].[OH2:39]>>[CH2:1]([CH3:2])[S:3](=[O:4])(=[O:5])[c:6]1[cH:7][c:8](-[c:12]2[c:13](-[c:26]3[c:27]([F:33])[n:28][cH:29][c:30]([CH3:32])[cH:31]3)[c:14]([NH2:23])[c:15]([CH3:22])[c:16]([C:18]([F:19])([F:20])[F:21])[cH:17]2)[cH:9][cH:10][cH:11]1Participants
5
Sources & evidence
- ORD record
- ord-4dd8f07ef23a40749769046162792f4d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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