Water → HCID 12137653, compound
Reaction equation
[CH:31]([Cl:32])([Cl:33])[Cl:34].[Cl:1][c:2]1[cH:3][cH:4][cH:5][c:6]([C:7]([O:8][OH:10])=[O:9])[cH:11]1.[F:12][c:13]1[c:14]([CH2:15][S:16][C:17]2=[N:18][O:19][C:20]([CH3:22])([CH2:23][CH3:24])[CH2:21]2)[c:25]([F:29])[cH:26][cH:27][cH:28]1.[OH2:30]>>[O:9]=[S:16]([CH2:15][c:14]1[c:13]([F:12])[cH:28][cH:27][cH:26][c:25]1[F:29])[C:17]1=[N:18][O:19][C:20]([CH3:22])([CH2:23][CH3:24])[CH2:21]1Participants
5
Sources & evidence
- ORD record
- ord-3cfe03443fd746d0ba72e713882adc29
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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