Hydrochloric Acid → HCID 178497001, compound
Reaction equation
[CH2:53]1[O:54][CH2:55][CH2:56][CH2:57]1.[CH3:20][CH2:21][N:22]=[C:23]=[N:24][CH2:25][CH2:26][CH2:27][N:28]([CH3:29])[CH3:30].[Cl:42][c:43]1[c:44]([C:45](=[O:46])[OH:47])[c:48]([F:52])[cH:49][cH:50][cH:51]1.[ClH:31].[NH2:1][c:2]1[n:3][c:4]2[c:5]([nH:6]1)[c:7]1[c:11]([c:12]([C:14](=[O:15])[O:16][CH3:17])[cH:13]2)[O:10][C:9]([CH3:18])([CH3:19])[CH2:8]1.[OH:32][n:33]1[c:34]2[c:35]([cH:36][cH:37][cH:38][cH:39]2)[n:40][n:41]1>>[NH:1]([c:2]1[n:3][c:4]2[c:5]([nH:6]1)[c:7]1[c:11]([c:12]([C:14](=[O:15])[O:16][CH3:17])[cH:13]2)[O:10][C:9]([CH3:18])([CH3:19])[CH2:8]1)[C:45]([c:44]1[c:43]([Cl:42])[cH:51][cH:50][cH:49][c:48]1[F:52])=[O:46]Participants
7
Sources & evidence
- ORD record
- ord-d6c1da55cafb47e59d1a53472b9cd793
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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