Hydrochloric Acid → HCID 22467222, compound
Reaction equation
[CH3:2][N:3]([CH2:4][CH2:5][CH2:6][N:7]=[C:8]=[N:9][CH2:10][CH3:11])[CH3:12].[CH3:51][N:52]([CH:53]([OH:54])[CH3:55])[CH3:56].[Cl:57][CH2:58][Cl:59].[ClH:1].[O:13]1[CH2:14][O:15][c:16]2[c:17]1[cH:18][cH:19][c:20]([CH:22]([C:23](=[O:24])[NH:25][S:26](=[O:27])(=[O:28])[c:29]1[c:30]([O:36][CH3:37])[cH:31][c:32]([CH3:35])[cH:33][cH:34]1)[c:38]1[cH:39][n:40]([CH3:50])[c:41]3[cH:42][c:43]([C:47](=[O:48])[OH:49])[cH:44][cH:45][c:46]13)[cH:21]2.[O:60]=[CH:61][N:62]([CH3:63])[CH3:64]>>[CH3:2][N:3]([CH2:4][CH2:5][O:49][C:47]([c:43]1[cH:42][c:41]2[n:40]([CH3:50])[cH:39][c:38]([CH:22]([c:20]3[cH:19][cH:18][c:17]4[c:16]([cH:21]3)[O:15][CH2:14][O:13]4)[C:23](=[O:24])[NH:25][S:26](=[O:27])(=[O:28])[c:29]3[c:30]([O:36][CH3:37])[cH:31][c:32]([CH3:35])[cH:33][cH:34]3)[c:46]2[cH:45][cH:44]1)=[O:48])[CH3:12]Participants
7
Sources & evidence
- ORD record
- ord-de247cd723d84e74b5f8967446fa9f07
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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