Acetic Acid → 5-(5-benzyl-1H-1,2,4-triazol-3-yl)-3-methylthiophene-2-carboxylic acid
Reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[n:9][c:10](-[c:13]2[cH:14][c:15]([CH3:25])[c:16]([C:18](=[O:19])[O:20][CH2:21][CH2:22][CH2:23][CH3:24])[s:17]2)[n:11][nH:12]1.[CH3:28][C:29](=[O:30])[OH:31].[CH3:32][CH2:33][OH:34].[Na+:27].[OH-:26].[OH2:35]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[n:9][c:10](-[c:13]2[cH:14][c:15]([CH3:25])[c:16]([C:18](=[O:19])[OH:20])[s:17]2)[n:11][nH:12]1Participants
7
Sources & evidence
- ORD record
- ord-ad7e8aff283f44b89e06970f9b6a90c7
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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