Hydrochloric Acid → HCID 9827187, compound
Reaction equation
[CH3:38][N:39]([CH3:40])[CH2:41][CH2:42][CH2:43][N:44]=[C:45]=[N:46][CH2:47][CH3:48].[CH3:55][CH2:56][O:57][C:58](=[O:59])[CH3:60].[CH3:61][S:62]([CH3:63])=[O:64].[CH3:65][c:66]1[cH:67][cH:68][cH:69][cH:70][cH:71]1.[CH:1](=[O:2])[c:3]1[cH:4][cH:5][cH:6][c:7]2[c:8]3[c:9]([nH:10][c:11]12)[c:12](=[O:36])[n:13]([CH2:22][C:23](=[O:24])[NH:25][CH:26]([CH:27]([C:28]([F:29])([F:30])[F:31])[OH:32])[CH:33]([CH3:34])[CH3:35])[c:14](-[c:16]1[cH:17][cH:18][cH:19][cH:20][cH:21]1)[cH:15]3.[ClH:37].[OH:49][C:50]([CH:51]([Cl:52])[Cl:53])=[O:54]>>[CH:1](=[O:2])[c:3]1[cH:4][cH:5][cH:6][c:7]2[c:8]3[c:9]([nH:10][c:11]12)[c:12](=[O:36])[n:13]([CH2:22][C:23](=[O:24])[NH:25][CH:26]([C:27]([C:28]([F:29])([F:30])[F:31])=[O:32])[CH:33]([CH3:34])[CH3:35])[c:14](-[c:16]1[cH:17][cH:18][cH:19][cH:20][cH:21]1)[cH:15]3Participants
8
Sources & evidence
- ORD record
- ord-2e8717a48a7c435b897f58c73e1ab937
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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