Toluene → HCID 67483870, compound
Reaction equation
[Br:37][c:38]1[cH:39][c:40]([N:44]=[C:45]=[O:46])[cH:41][cH:42][cH:43]1.[CH3:1][O:2][C:3]([CH2:4][CH2:5][NH:6][C:7]([c:8]1[cH:9][cH:10][c:11]([CH2:14][NH:15][c:16]2[cH:17][cH:18][c:19]([C:22]3=[CH:23][CH2:24][CH2:25][CH2:26][CH2:27]3)[cH:20][cH:21]2)[cH:12][cH:13]1)=[O:28])=[O:29].[CH3:30][c:31]1[cH:32][cH:33][cH:34][cH:35][cH:36]1.[CH3:47][CH2:48][O:49][C:50](=[O:51])[CH3:52].[O:53]=[CH:54][N:55]([CH3:56])[CH3:57]>>[CH3:1][O:2][C:3]([CH2:4][CH2:5][NH:6][C:7]([c:8]1[cH:9][cH:10][c:11]([CH2:14][N:15]([c:16]2[cH:17][cH:18][c:19]([C:22]3=[CH:23][CH2:24][CH2:25][CH2:26][CH2:27]3)[cH:20][cH:21]2)[C:45]([NH:44][c:40]2[cH:39][c:38]([Br:37])[cH:43][cH:42][cH:41]2)=[O:46])[cH:12][cH:13]1)=[O:28])=[O:29]Participants
6
Sources & evidence
- ORD record
- ord-b0af68f507e64b8c8ed0ad727345cb22
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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