Toluene → HCID 975849, compound
Reaction equation
[CH2:25]([SiH:26]([CH2:27][CH3:28])[CH2:29][CH3:30])[CH3:31].[CH3:32][c:33]1[cH:34][cH:35][cH:36][cH:37][cH:38]1.[Cl:9][c:10]1[cH:11][cH:12][c:13]([CH:14]=[O:15])[cH:16][cH:17]1.[NH2:1][c:2]1[n:3][cH:4][c:5]([Br:8])[cH:6][cH:7]1.[OH:18][C:19]([C:20]([F:21])([F:22])[F:23])=[O:24]>>[NH:1]([c:2]1[n:3][cH:4][c:5]([Br:8])[cH:6][cH:7]1)[CH2:14][c:13]1[cH:12][cH:11][c:10]([Cl:9])[cH:17][cH:16]1Participants
6
Sources & evidence
- ORD record
- ord-d76b1b6b92614bddb7dfee94cff2bcf9
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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