Water → 2-(Ethanesulfonyl)-5-nitrobenzonitrile
Reaction equation
[CH2:1]([CH3:2])[SH:3].[CH3:16][CH2:17][N:18]([CH2:19][CH3:20])[CH2:21][CH3:22].[Cl:40][CH2:41][Cl:42].[F:4][c:5]1[c:6]([C:7]#[N:8])[cH:9][c:10]([N+:13](=[O:14])[O-:15])[cH:11][cH:12]1.[O:35]=[CH:36][N:37]([CH3:38])[CH3:39].[OH2:34].[OH:23][O:24][C:25]([c:26]1[cH:27][c:28]([Cl:29])[cH:30][cH:31][cH:32]1)=[O:33]>>[CH2:1]([CH3:2])[S:3]([c:5]1[c:6]([C:7]#[N:8])[cH:9][c:10]([N+:13](=[O:14])[O-:15])[cH:11][cH:12]1)(=[O:23])=[O:34]Participants
8
Sources & evidence
- ORD record
- ord-dab2da25ba464314a9e334e209e37b86
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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