Acetone → HCID 54410119, compound
Reaction equation
[CH3:42][C:43](=[O:44])[CH3:45].[F:15][S:16](=[O:17])(=[O:18])[c:19]1[cH:20][c:21]([S:25](=[O:26])(=[O:27])[Cl:28])[cH:22][cH:23][cH:24]1.[N:34]12[CH2:35][CH2:36][N:37]([CH2:38][CH2:39]1)[CH2:40][CH2:41]2.[NH2:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[CH:11]=[CH:12][C:13]#[N:14])[cH:6][cH:7]1.[S:29]([Cl:30])([Cl:31])(=[O:32])=[O:33]>>[NH:1]([c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[CH:11]=[CH:12][C:13]#[N:14])[cH:6][cH:7]1)[S:25]([c:21]1[cH:20][c:19]([S:16]([F:15])(=[O:17])=[O:18])[cH:24][cH:23][cH:22]1)(=[O:26])=[O:27]Participants
6
Sources & evidence
- ORD record
- ord-c01c3bb0bf6b436b9d6010ba2fd47ed2
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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