Hydrochloric Acid → HCID 68419431, compound
Reaction equation
[CH3:30][NH:31][CH3:32].[CH:43]([N:44]([CH:45]([CH3:46])[CH3:47])[CH2:48][CH3:49])([CH3:50])[CH3:51].[Cl:1][c:2]1[n:3][c:4]([C:9](=[O:10])[NH:11][CH:12]2[CH:13]([O:27][CH3:28])[CH2:14][N:15]([c:18]3[s:19][c:20]([C:24](=[O:25])[OH:26])[c:21]([CH3:23])[n:22]3)[CH2:16][CH2:17]2)[nH:5][c:6]1[CH2:7][CH3:8].[Cl:52][CH2:53][Cl:54].[ClH:29].[OH:33][n:34]1[c:35]2[c:36]([cH:37][cH:38][cH:39][cH:40]2)[n:41][n:42]1>>[Cl:1][c:2]1[n:3][c:4]([C:9](=[O:10])[NH:11][CH:12]2[CH:13]([O:27][CH3:28])[CH2:14][N:15]([c:18]3[s:19][c:20]([C:24](=[O:25])[N:31]([CH3:30])[CH3:32])[c:21]([CH3:23])[n:22]3)[CH2:16][CH2:17]2)[nH:5][c:6]1[CH2:7][CH3:8]Participants
7
Sources & evidence
- ORD record
- ord-74e4905705484f46828c78d50f0a3762
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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