Trifluoroacetic acid → 2-[8-(Benzothiazol-2-ylcarbamoyl)-3,4-dihydro-1H-isoquinolin-2-yl]-5-{3-[4-(2-morpholin-4-yl-ethoxy)-phenoxy]-propyl}-thiazole-4-carboxylic acid
Reaction equation
[F:1][C:2]([F:3])([F:4])[C:5]([OH:6])=[O:7].[O:55]1[CH2:56][CH2:57][N:58]([CH2:61][CH2:62][O:63][c:64]2[cH:65][cH:66][c:67]([OH:68])[cH:69][cH:70]2)[CH2:59][CH2:60]1.[s:8]1[c:9]([NH:17][C:18](=[O:19])[c:20]2[cH:21][cH:22][cH:23][c:24]3[c:29]2[CH2:28][N:27]([c:30]2[s:31][c:32]([CH2:38][CH2:39][CH2:40][O:41][c:42]4[cH:43][cH:44][c:45](-[c:48]5[c:49]([C:50]#[N:51])[cH:52][s:53][cH:54]5)[cH:46][cH:47]4)[c:33]([C:35](=[O:36])[OH:37])[n:34]2)[CH2:26][CH2:25]3)[n:10][c:11]2[c:12]1[cH:13][cH:14][cH:15][cH:16]2>>[s:8]1[c:9]([NH:17][C:18](=[O:19])[c:20]2[cH:21][cH:22][cH:23][c:24]3[c:29]2[CH2:28][N:27]([c:30]2[s:31][c:32]([CH2:38][CH2:39][CH2:40][O:41][c:42]4[cH:43][cH:44][c:45]([O:63][CH2:62][CH2:61][N:58]5[CH2:57][CH2:56][O:55][CH2:60][CH2:59]5)[cH:46][cH:47]4)[c:33]([C:35](=[O:36])[OH:37])[n:34]2)[CH2:26][CH2:25]3)[n:10][c:11]2[c:12]1[cH:13][cH:14][cH:15][cH:16]2Participants
4
Reactant 3
Product 1
Sources & evidence
- ORD record
- ord-cc46953a50204578a927e6efb9a9adc2
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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