Benzoic Acid → 5-[4-[2-[4-Methyl-2-propyl-6-oxo-1,6-dihydropyrimidin-1-yl]ethoxy]phenylmethylene]thiazolidine-2,4-dione
Reaction equation
[CH2:39]1[CH2:40][CH2:41][NH:42][CH2:43][CH2:44]1.[CH3:1][c:2]1[n:3][c:4]([CH2:20][CH2:21][CH3:22])[n:5]([CH2:9][CH2:10][O:11][c:12]2[cH:13][cH:14][c:15]([CH:16]=[O:17])[cH:18][cH:19]2)[c:6](=[O:8])[cH:7]1.[CH3:45][c:46]1[cH:47][cH:48][cH:49][cH:50][cH:51]1.[OH2:52].[OH:30][C:31]([c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1)=[O:38].[S:23]1[C:24](=[O:29])[NH:25][C:26](=[O:28])[CH2:27]1>>[CH3:1][c:2]1[n:3][c:4]([CH2:20][CH2:21][CH3:22])[n:5]([CH2:9][CH2:10][O:11][c:12]2[cH:13][cH:14][c:15]([CH:16]=[C:27]3[S:23][C:24](=[O:29])[NH:25][C:26]3=[O:28])[cH:18][cH:19]2)[c:6](=[O:8])[cH:7]1Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-4e6c5646b11c4702bb116a8f6343f699
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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