Hydrochloric Acid → HCID 57736426, compound
Reaction equation
[CH2:36]([N:37]=[C:38]=[N:39][CH2:40][CH2:41][CH2:42][N:43]([CH3:44])[CH3:45])[CH3:46].[CH2:64]([Cl:65])[Cl:66].[CH3:57][CH2:58][N:59]([CH2:60][CH3:61])[CH2:62][CH3:63].[ClH:35].[F:1][c:2]1[c:3]([CH:9]([c:10]2[c:11]([CH3:19])[cH:12][c:13]([C:16](=[O:17])[OH:18])[n:14][cH:15]2)[S:20](=[O:21])(=[O:22])[c:23]2[cH:24][c:25]([CH3:30])[c:26]([F:29])[cH:27][cH:28]2)[cH:4][c:5]([F:8])[cH:6][cH:7]1.[NH2:31][CH2:32][CH2:33][OH:34].[OH2:67].[OH:47][n:48]1[c:49]2[cH:50][cH:51][cH:52][cH:53][c:54]2[n:55][n:56]1>>[F:1][c:2]1[c:3]([CH:9]([c:10]2[c:11]([CH3:19])[cH:12][c:13]([C:16](=[O:18])[NH:31][CH2:32][CH2:33][OH:34])[n:14][cH:15]2)[S:20](=[O:21])(=[O:22])[c:23]2[cH:24][c:25]([CH3:30])[c:26]([F:29])[cH:27][cH:28]2)[cH:4][c:5]([F:8])[cH:6][cH:7]1Participants
9
Sources & evidence
- ORD record
- ord-d70e44f6b68f48d1aab1d834c168ea79
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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