Trifluoroacetic acid → 2-[8-(Benzothiazol-2-ylcarbamoyl)-3,4-dihydro-1H-isoquinolin-2-yl]-5-{3-[4-(2-dimethylamino-ethoxy)-phenoxy]-propyl}-thiazole-4-carboxylic acid
Reaction equation
[CH3:55][N:56]([CH2:57][CH2:58][O:59][c:60]1[cH:61][cH:62][c:63]([OH:66])[cH:64][cH:65]1)[CH3:67].[F:1][C:2]([F:3])([F:4])[C:5]([OH:6])=[O:7].[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:46]5[c:47]([C:48]#[N:49])[cH:50][s:51][cH:52]5)[cH:53][cH:54]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:66][c:63]4[cH:62][cH:61][c:60]([O:59][CH2:58][CH2:57][N:56]([CH3:55])[CH3:67])[cH:65][cH:64]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-1893837be3e5420a8c00f60f20c469cb
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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