Bicarbonate Ion → 3-[Chloro(cyclohexyl)methyl]-2-ethyl-5-[4-(trifluoromethyl)phenyl]thiophene
Reaction equation
[C:30](=[O:31])([O-:32])[OH:33].[CH3:35][c:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1.[CH:1]1([CH:7]([OH:8])[c:9]2[c:10]([CH2:24][CH3:25])[s:11][c:12](-[c:14]3[cH:15][cH:16][c:17]([C:20]([F:21])([F:22])[F:23])[cH:18][cH:19]3)[cH:13]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1.[Na+:34].[S:26]([Cl:27])([Cl:28])=[O:29]>>[CH:1]1([CH:7]([c:9]2[c:10]([CH2:24][CH3:25])[s:11][c:12](-[c:14]3[cH:15][cH:16][c:17]([C:20]([F:21])([F:22])[F:23])[cH:18][cH:19]3)[cH:13]2)[Cl:28])[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1Participants
6
Sources & evidence
- ORD record
- ord-78d01d1dec8f447d890942429901af8c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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