Hydrochloric Acid → HCID 57469092, compound
Reaction equation
[CH2:50]1[O:51][CH2:52][CH2:53][CH2:54]1.[CH3:6][CH2:7][N:8]([CH2:9][CH3:10])[CH2:11][CH3:12].[CH:1]1([CH2:4][NH2:5])[CH2:2][CH2:3]1.[ClH:13].[F:14][C:15]([c:16]1[n:17][c:18](-[c:32]2[cH:33][c:34](-[c:38]3[cH:39][c:40]([S:44](=[O:45])(=[O:46])[Cl:47])[cH:41][cH:42][cH:43]3)[n:35][cH:36][cH:37]2)[n:19][c:20](-[c:22]2[cH:23][cH:24][c:25]([C:28]([F:29])([F:30])[F:31])[cH:26][cH:27]2)[cH:21]1)([F:48])[F:49]>>[CH:1]1([CH2:4][NH:5][S:44]([c:40]2[cH:39][c:38](-[c:34]3[cH:33][c:32](-[c:18]4[n:17][c:16]([C:15]([F:14])([F:48])[F:49])[cH:21][c:20](-[c:22]5[cH:23][cH:24][c:25]([C:28]([F:29])([F:30])[F:31])[cH:26][cH:27]5)[n:19]4)[cH:37][cH:36][n:35]3)[cH:43][cH:42][cH:41]2)(=[O:45])=[O:46])[CH2:2][CH2:3]1Participants
6
Sources & evidence
- ORD record
- ord-ee29c3e9d28a45b7a7ecba2518fd0e50
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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