Trifluoroacetic acid → {5-[Benzothiazol-2-ylmethyl-(4-fluoro-benzenesulfonyl)-amino]-2-propyl-benzoimidazol-1-yl}-acetic acid
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH2:7][n:8]1[c:9]([CH2:38][CH2:39][CH3:40])[n:10][c:11]2[c:12]1[cH:13][cH:14][c:15]([N:17]([S:18](=[O:19])(=[O:20])[c:21]1[cH:22][cH:23][c:24]([F:27])[cH:25][cH:26]1)[CH2:28][c:29]1[s:30][c:31]3[c:32]([n:33]1)[cH:34][cH:35][cH:36][cH:37]3)[cH:16]2)=[O:41].[F:42][C:43]([F:44])([F:45])[C:46]([OH:47])=[O:48]>>[O:5]=[C:6]([CH2:7][n:8]1[c:9]([CH2:38][CH2:39][CH3:40])[n:10][c:11]2[c:12]1[cH:13][cH:14][c:15]([N:17]([S:18](=[O:19])(=[O:20])[c:21]1[cH:22][cH:23][c:24]([F:27])[cH:25][cH:26]1)[CH2:28][c:29]1[s:30][c:31]3[c:32]([n:33]1)[cH:34][cH:35][cH:36][cH:37]3)[cH:16]2)[OH:41]Participants
3
Sources & evidence
- ORD record
- ord-03780a180ca04d4ba4b68220e645acd7
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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