Hydrochloric Acid → Hydrochloric Acid
Reaction equation
[CH2:34]([C:35]#[C:36][CH3:37])[O:38][c:39]1[cH:40][cH:41][c:42]([S:45](=[O:46])(=[O:47])[N:48]([CH:49]([C:50](=[O:51])[NH:52][OH:53])[CH:54]([CH3:55])[CH3:56])[CH2:57][CH2:58][CH2:59][N:60]2[CH2:61][CH2:62][N:63]([CH3:66])[CH2:64][CH2:65]2)[cH:43][cH:44]1.[CH2:8]([O:9][c:10]1[cH:11][cH:12][c:13]([S:14]([N:15]([CH2:16][CH2:17][CH2:18][Cl:33])[CH:19]([CH:20]([CH3:21])[CH3:22])[C:23]([O-:24])=[O:25])(=[O:26])=[O:27])[cH:28][cH:29]1)[C:30]#[C:31][CH3:32].[CH3:1][N:2]1[CH2:3][CH2:4][NH:5][CH2:6][CH2:7]1.[ClH:67]>>[CH2:34]([C:35]#[C:36][CH3:37])[O:38][c:39]1[cH:40][cH:41][c:42]([S:45](=[O:46])(=[O:47])[N:48]([CH:49]([C:50](=[O:51])[NH:52][OH:53])[CH:54]([CH3:55])[CH3:56])[CH2:57][CH2:58][CH2:59][N:60]2[CH2:61][CH2:62][N:63]([CH3:66])[CH2:64][CH2:65]2)[cH:43][cH:44]1.[ClH:33]Participants
6
Sources & evidence
- ORD record
- ord-c763fbf6a60b44b788ec110c7b232127
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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