Acetic Acid → 5-(4-{1-Ethyl-1-[4-(2-hydroxy-3,3-dimethyl-butoxy)-3-methyl-phenyl)-propyl}-2-methyl-benzylidene)-thiazolidine-2,4-dione
Reaction equation
[C:37]([OH:38])(=[O:39])[CH3:40].[CH2:1]([CH3:2])[C:3]([CH2:4][CH3:5])([c:6]1[cH:7][c:8]([CH3:20])[c:9]([O:12][CH2:13][CH:14]([C:15]([CH3:16])([CH3:17])[CH3:18])[OH:19])[cH:10][cH:11]1)[c:21]1[cH:22][c:23]([CH3:29])[c:24]([CH:25]=[O:26])[cH:27][cH:28]1.[CH3:47][c:48]1[cH:49][cH:50][cH:51][cH:52][cH:53]1.[NH:41]1[CH2:42][CH2:43][CH2:44][CH2:45][CH2:46]1.[S:30]1[C:31](=[O:36])[NH:32][C:33](=[O:35])[CH2:34]1>>[CH2:1]([CH3:2])[C:3]([CH2:4][CH3:5])([c:6]1[cH:7][c:8]([CH3:20])[c:9]([O:12][CH2:13][CH:14]([C:15]([CH3:16])([CH3:17])[CH3:18])[OH:19])[cH:10][cH:11]1)[c:21]1[cH:22][c:23]([CH3:29])[c:24]([CH:25]=[C:34]2[S:30][C:31](=[O:36])[NH:32][C:33]2=[O:35])[cH:27][cH:28]1Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-8e053aa27d294e5f977e4715aea991b2
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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