Hydrochloric Acid → 5-[3-(4-Trifluoromethyl-phenyl)-benzo[d]isothiazol-6-yl]-pent-4-yn-1-ol
Reaction equation
[CH2:28]1[CH2:29][CH2:30][NH:31][CH2:32][CH2:33]1.[CH2:34]([CH2:35][CH2:36][C:37]#[CH:38])[OH:39].[ClH:40].[Cu:41][I:42].[F:1][C:2]([c:3]1[cH:4][cH:5][c:6](-[c:9]2[n:10][s:11][c:12]3[c:13]2[cH:14][cH:15][c:16]([O:18][S:19]([C:20]([F:21])([F:22])[F:23])(=[O:24])=[O:25])[cH:17]3)[cH:7][cH:8]1)([F:26])[F:27].[OH2:43]>>[F:1][C:2]([c:3]1[cH:4][cH:5][c:6](-[c:9]2[n:10][s:11][c:12]3[c:13]2[cH:14][cH:15][c:16]([C:38]#[C:37][CH2:36][CH2:35][CH2:34][OH:39])[cH:17]3)[cH:7][cH:8]1)([F:26])[F:27]Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-266d04af9cf84c3b9a20077f209ee229
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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