Toluene → HCID 178473488, compound
Reaction equation
[CH3:1][CH:2]1[O:3][c:4]2[c:5]([cH:17][cH:18][cH:19][cH:20]2)[N:6]([CH3:16])[C:7](=[O:15])[CH:8]1[NH:9][C:10]([CH:11]([CH3:12])[OH:13])=[O:14].[CH3:21][CH2:22][N:23]([CH2:24][CH3:25])[CH2:26][CH3:27].[CH3:50][c:51]1[cH:52][cH:53][cH:54][cH:55][cH:56]1.[Cl:28][C:29](=[O:30])[O:31][c:32]1[cH:33][cH:34][c:35]([N+:36]([O-:37])=[O:38])[cH:39][cH:40]1.[F:41][C:42]([CH2:43][NH2:44])([C:45]([F:46])([F:47])[F:48])[F:49]>>[CH3:1][CH:2]1[O:3][c:4]2[c:5]([cH:17][cH:18][cH:19][cH:20]2)[N:6]([CH3:16])[C:7](=[O:15])[CH:8]1[NH:9][C:10]([CH:11]([CH3:12])[O:13][C:29](=[O:30])[NH:44][CH2:43][C:42]([F:41])([C:45]([F:46])([F:47])[F:48])[F:49])=[O:14]Participants
6
Sources & evidence
- ORD record
- ord-20e816f583bb4a7a9aea7e30fdd34b05
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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