Hydrochloric Acid → HCID 9873179, compound
Reaction equation
[CH2:1]([CH:2]=[CH2:3])[O:4][C:5]([C:6]([CH2:7][c:8]1[n:9]([CH2:34][c:35]2[cH:36][cH:37][c:38]([Cl:41])[cH:39][cH:40]2)[c:10]2[cH:11][cH:12][c:13]([O:22][CH2:23][c:24]3[n:25][cH:26][c:27]4[cH:28][cH:29][cH:30][cH:31][c:32]4[cH:33]3)[cH:14][c:15]2[c:16]1[S:17][C:18]([CH3:19])([CH3:20])[CH3:21])([CH3:42])[CH3:43])=[O:44].[CH2:50]1[O:51][CH2:52][CH2:53][CH2:54]1.[CH3:45][OH:46].[ClH:49].[Li+:48].[OH-:47]>>[O:4]=[C:5]([C:6]([CH2:7][c:8]1[n:9]([CH2:34][c:35]2[cH:36][cH:37][c:38]([Cl:41])[cH:39][cH:40]2)[c:10]2[cH:11][cH:12][c:13]([O:22][CH2:23][c:24]3[n:25][cH:26][c:27]4[cH:28][cH:29][cH:30][cH:31][c:32]4[cH:33]3)[cH:14][c:15]2[c:16]1[S:17][C:18]([CH3:19])([CH3:20])[CH3:21])([CH3:42])[CH3:43])[OH:44]Participants
7
Sources & evidence
- ORD record
- ord-c6b9bd68b71d46a4921ef32df9624b8d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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