Benzene → HCID 13674776, compound
Reaction equation
[CH3:18][c:19]1[c:20]([NH2:21])[c:22]([CH3:23])[cH:24][cH:25][cH:26]1.[Na+:28].[OH-:27].[OH2:35].[OH:5][CH:6]([CH2:7][NH:8][c:9]1[c:10]([CH3:16])[cH:11][cH:12][cH:13][c:14]1[CH3:15])[CH3:17].[S:1]([Cl:2])([Cl:3])=[O:4].[cH:29]1[cH:30][cH:31][cH:32][cH:33][cH:34]1>>[Cl:3][CH:6]([CH2:7][NH:8][c:9]1[c:10]([CH3:16])[cH:11][cH:12][cH:13][c:14]1[CH3:15])[CH3:17]Participants
8
Sources & evidence
- ORD record
- ord-a10429cf873e4ca8834fb512213c2f04
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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