Acetic Acid → 3-(4-{4-[2-Dimethylcarbamoyl-2-(toluene-4-sulfonylamino)-ethyl]-phenoxy}-phenyl)-propionic acid methyl ester
Reaction equation
[CH3:3][O:4][C:5]([CH2:6][CH2:7][c:8]1[cH:9][cH:10][c:11]([O:14][c:15]2[cH:16][cH:17][c:18]([CH2:21][CH:22]([C:23]([N:24]([CH3:25])[CH3:26])=[O:27])[NH2:28])[cH:19][cH:20]2)[cH:12][cH:13]1)=[O:29].[CH3:41][C:42](=[O:43])[OH:44].[Cl:45][CH2:46][Cl:47].[ClH:1].[ClH:2].[c:30]1([CH3:40])[cH:31][cH:32][c:33]([S:36](=[O:37])(=[O:38])[Cl:39])[cH:34][cH:35]1>>[CH3:3][O:4][C:5]([CH2:6][CH2:7][c:8]1[cH:9][cH:10][c:11]([O:14][c:15]2[cH:16][cH:17][c:18]([CH2:21][CH:22]([C:23]([N:24]([CH3:25])[CH3:26])=[O:27])[NH:28][S:36]([c:33]3[cH:32][cH:31][c:30]([CH3:40])[cH:35][cH:34]3)(=[O:37])=[O:38])[cH:19][cH:20]2)[cH:12][cH:13]1)=[O:29]Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-4e1bb7661d6e40bfa386106f62d90822
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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