Toluene → HCID 67177129, compound
Reaction equation
[CH2:28]1[CH2:32][O:31][CH2:30][CH2:29][O:33]1.[CH3:34][CH2:35][N:36]([CH2:37][CH3:38])[CH2:39][CH3:40].[CH3:51][c:52]1[cH:53][cH:54][cH:55][cH:56][cH:57]1.[Cl:41][C:42](=[O:43])[Cl:44].[F:45][C:46]([CH2:47][NH2:48])([F:49])[F:50].[NH2:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[n:9][c:10]([N:21]3[CH:22]([CH3:27])[CH2:23][O:24][CH2:25][CH2:26]3)[c:11]3[c:12]([n:13]2)[CH2:14][N:15]([C:18]([CH3:19])=[O:20])[CH2:16][CH2:17]3)[cH:6][cH:7]1>>[NH:1]([c:2]1[cH:3][cH:4][c:5](-[c:8]2[n:9][c:10]([N:21]3[CH:22]([CH3:27])[CH2:23][O:24][CH2:25][CH2:26]3)[c:11]3[c:12]([n:13]2)[CH2:14][N:15]([C:18]([CH3:19])=[O:20])[CH2:16][CH2:17]3)[cH:6][cH:7]1)[C:28](=[O:33])[NH:48][CH2:47][C:46]([F:45])([F:49])[F:50]Participants
7
Sources & evidence
- ORD record
- ord-43b5627efdc5490dbd851012979b1efd
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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