Citric Acid → {2-[7-(methyl{[2-(trifluoromethyl)phenyl]sulfonyl}amino)-1H-indol-2-yl]-4,5-dihydro-1,3-thiazol-5-yl}acetic acid
Reaction equation
[CH3:1][N:2]([c:3]1[cH:4][cH:5][cH:6][c:7]2[cH:8][c:9]([C:12]3=[N:16][CH2:15][CH:14]([CH2:17][C:18](=[O:19])[O:20][CH2:21][CH3:22])[S:13]3)[nH:10][c:11]12)[S:23](=[O:24])(=[O:25])[c:26]1[c:27]([C:32]([F:33])([F:34])[F:35])[cH:28][cH:29][cH:30][cH:31]1.[K+:37].[O:51]1[CH2:52][CH2:53][CH2:54][CH2:55]1.[OH-:36].[OH:38][C:39]([CH2:40][C:41]([C:42](=[O:43])[OH:44])([CH2:45][C:46](=[O:47])[OH:48])[OH:49])=[O:50]>>[CH3:1][N:2]([c:3]1[cH:4][cH:5][cH:6][c:7]2[cH:8][c:9]([C:12]3=[N:16][CH2:15][CH:14]([CH2:17][C:18](=[O:19])[OH:20])[S:13]3)[nH:10][c:11]12)[S:23](=[O:24])(=[O:25])[c:26]1[c:27]([C:32]([F:33])([F:34])[F:35])[cH:28][cH:29][cH:30][cH:31]1Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-4de1f5fbc7bc4d2ab7b4c9a4e018d1b2
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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