Acetone → HCID 178527109, compound
Reaction equation
[CH3:32][C:33](=[O:34])[CH3:35].[Cl:1][c:2]1[cH:3][cH:4][c:5]2[c:14]([cH:15]1)[CH2:13][c:12]1[c:7]([cH:8][c:9](-[c:16]3[n:17][n:18][n:19][nH:20]3)[cH:10][cH:11]1)[S:6]2.[Cl:21][c:22]1[cH:23][c:24]([C:29](=[O:26])[O:30][OH:31])[cH:25][cH:27][cH:28]1.[OH2:36]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]2[c:14]([cH:15]1)[CH2:13][c:12]1[c:7]([cH:8][c:9](-[c:16]3[n:17][n:18][n:19][nH:20]3)[cH:10][cH:11]1)[S:6]2=[O:26]Participants
5
Sources & evidence
- ORD record
- ord-a489e084a4a14dfd922659f93834dddd
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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