Acetic Acid → 6-Methyl-5-(m-trifluoromethylbenzylmercapto)-pyridine-2-carboxylic acid methyl ester
Reaction equation
[CH3:15][O:16][C:17](=[O:18])[c:19]1[n:20][c:21]([CH3:28])[c:22]([N+:25]([O-:26])=[O:27])[cH:23][cH:24]1.[CH3:29][C:30](=[O:31])[OH:32].[CH3:33][N:34]([CH3:35])[CH:36]=[O:37].[F:3][C:4]([c:5]1[cH:6][c:7]([CH2:8][SH:9])[cH:10][cH:11][cH:12]1)([F:13])[F:14].[H-:1].[Na+:2].[OH2:38]>>[F:3][C:4]([c:5]1[cH:6][c:7]([CH2:8][S:9][c:22]2[c:21]([CH3:28])[n:20][c:19]([C:17]([O:16][CH3:15])=[O:18])[cH:24][cH:23]2)[cH:10][cH:11][cH:12]1)([F:13])[F:14]Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-f31c01ff50c74b1e8517a408911d8d86
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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