Trifluoroacetic acid → 1-{2-[4-(6-Trifluoromethyl-benzo[b]thiophen-3-yl)-piperazin-1-yl]-ethyl}-cyclopropanecarboxylic acid
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[C:8]1([CH2:11][CH2:12][N:13]2[CH2:14][CH2:15][N:16]([c:19]3[c:20]4[c:21]([s:22][cH:23]3)[cH:24][c:25]([C:28]([F:29])([F:30])[F:31])[cH:26][cH:27]4)[CH2:17][CH2:18]2)[CH2:9][CH2:10]1.[OH:32][C:33]([C:34]([F:35])([F:36])[F:37])=[O:38]>>[O:5]=[C:6]([OH:7])[C:8]1([CH2:11][CH2:12][N:13]2[CH2:14][CH2:15][N:16]([c:19]3[c:20]4[c:21]([s:22][cH:23]3)[cH:24][c:25]([C:28]([F:29])([F:30])[F:31])[cH:26][cH:27]4)[CH2:17][CH2:18]2)[CH2:9][CH2:10]1Participants
3
Sources & evidence
- ORD record
- ord-2d60fc6f585945dd80a9acd5d96c5056
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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