Hydrochloric Acid → HCID 69155979, compound
Reaction equation
[CH2:44]1[O:45][CH2:46][CH2:47][CH2:48]1.[CH3:1][O:2][C:3]([CH2:4][NH:5][S:6](=[O:7])(=[O:8])[c:9]1[cH:10][cH:11][c:12]([CH2:15][n:16]2[c:17](=[O:37])[c:18]3[cH:19][cH:20][c:21]([Br:36])[cH:22][c:23]3[c:24](-[c:30]3[cH:31][cH:32][cH:33][cH:34][cH:35]3)[c:25]2[C:26]([CH2:27][CH3:28])=[O:29])[cH:13][cH:14]1)=[O:38].[CH3:39][OH:40].[ClH:43].[Na+:42].[OH-:41]>>[O:2]=[C:3]([CH2:4][NH:5][S:6](=[O:7])(=[O:8])[c:9]1[cH:10][cH:11][c:12]([CH2:15][n:16]2[c:17](=[O:37])[c:18]3[cH:19][cH:20][c:21]([Br:36])[cH:22][c:23]3[c:24](-[c:30]3[cH:31][cH:32][cH:33][cH:34][cH:35]3)[c:25]2[C:26]([CH2:27][CH3:28])=[O:29])[cH:13][cH:14]1)[OH:38]Participants
7
Sources & evidence
- ORD record
- ord-4e54138d443149e4b6139e2221db2a8d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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