Benzoic Acid → 2-{4-[4-(2,4-Dioxothiazolidin-5-ylidenemethyl)-phenoxy]-phenyl}-3-p-tolylacrylic acid
Reaction equation
[CH2:44]1[CH2:45][CH2:46][NH:47][CH2:48][CH2:49]1.[CH3:51][c:52]1[cH:53][cH:54][cH:55][cH:56][cH:57]1.[CH:1](=[O:2])[c:3]1[cH:4][cH:5][c:6]([O:7][c:8]2[cH:9][cH:10][c:11]([C:14]([C:15](=[O:16])[OH:17])=[CH:18][c:19]3[cH:20][cH:21][c:22]([CH3:25])[cH:23][cH:24]3)[cH:12][cH:13]2)[cH:26][cH:27]1.[ClH:50].[OH:35][C:36]([c:37]1[cH:38][cH:39][cH:40][cH:41][cH:42]1)=[O:43].[S:28]1[C:29](=[O:34])[NH:30][C:31](=[O:33])[CH2:32]1>>[CH:1]([c:3]1[cH:4][cH:5][c:6]([O:7][c:8]2[cH:9][cH:10][c:11]([C:14]([C:15](=[O:16])[OH:17])=[CH:18][c:19]3[cH:20][cH:21][c:22]([CH3:25])[cH:23][cH:24]3)[cH:12][cH:13]2)[cH:26][cH:27]1)=[C:32]1[S:28][C:29](=[O:34])[NH:30][C:31]1=[O:33]Participants
7
Sources & evidence
- ORD record
- ord-97e117203a434d2cb149150d92888da1
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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