Benzene → HCID 22249986, compound
Reaction equation
[OH:1][CH2:2][CH2:3][c:4]1[c:5]([CH3:24])[n:6][c:7]2[n:8]([c:9]1[OH:10])[n:11][c:12]([CH3:23])[c:13]2-[c:14]1[c:15]([CH3:22])[cH:16][c:17]([CH3:21])[cH:18][c:19]1[CH3:20].[S:25]([Cl:26])([Cl:27])=[O:28].[cH:29]1[cH:30][cH:31][cH:32][cH:33][cH:34]1>>[CH2:2]1[CH2:3][c:4]2[c:5]([CH3:24])[n:6][c:7]3[n:8]([c:9]2[O:10]1)[n:11][c:12]([CH3:23])[c:13]3-[c:14]1[c:15]([CH3:22])[cH:16][c:17]([CH3:21])[cH:18][c:19]1[CH3:20]Participants
4
Sources & evidence
- ORD record
- ord-a76c60bbc5c74a069607a1d97cd3b2b6
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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