Acetone → HCID 19066087, compound
Reaction equation
[CH2:12]([CH3:13])[O:14][C:15]([CH2:16][c:17]1[c:18]([CH3:23])[n:19][c:20]([SH:22])[s:21]1)=[O:24].[CH3:31][C:32](=[O:33])[CH3:34].[Cl:1][c:2]1[n:3][cH:4][c:5]([C:8]([F:9])([F:10])[F:11])[cH:6][cH:7]1.[K+:25].[K+:26].[O-:27][C:28]([O-:29])=[O:30]>>[c:2]1([S:22][c:20]2[n:19][c:18]([CH3:23])[c:17]([CH2:16][C:15]([O:14][CH2:12][CH3:13])=[O:24])[s:21]2)[n:3][cH:4][c:5]([C:8]([F:9])([F:10])[F:11])[cH:6][cH:7]1Participants
6
Sources & evidence
- ORD record
- ord-af7c5b0327504cb6b1ffc9f1b6745e29
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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