Hydrochloric Acid → HCID 178480536, compound
Reaction equation
[CH3:49][CH2:50][O:51][C:52](=[O:53])[CH3:54].[CH:40]([N:41]([CH:42]([CH3:43])[CH3:44])[CH2:45][CH3:46])([CH3:47])[CH3:48].[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][NH:7][C:8](=[O:9])[c:10]2[c:11](=[O:22])[c:12]3[c:13]([n:14]([CH3:16])[cH:15]2)[s:17][c:18]([CH2:20][Cl:21])[cH:19]3)[cH:23][cH:24]1.[ClH:25].[O:26]1[CH2:27][CH:28]([CH:32]([OH:33])[c:34]2[cH:35][cH:36][cH:37][cH:38][cH:39]2)[NH:29][CH2:30][CH2:31]1.[O:55]=[CH:56][N:57]([CH3:58])[CH3:59]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][NH:7][C:8](=[O:9])[c:10]2[c:11](=[O:22])[c:12]3[c:13]([n:14]([CH3:16])[cH:15]2)[s:17][c:18]([CH2:20][N:29]2[CH:28]([CH:32]([OH:33])[c:34]4[cH:35][cH:36][cH:37][cH:38][cH:39]4)[CH2:27][O:26][CH2:31][CH2:30]2)[cH:19]3)[cH:23][cH:24]1Participants
7
Sources & evidence
- ORD record
- ord-060c46c91a4e4a7ea37e91d35389fcbc
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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