Hydrochloric Acid → HCID 178466275, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]([O:35][CH2:36][CH3:37])[c:8]([C:11]2=[N:15][C:14]([CH3:16])([c:17]3[cH:18][cH:19][c:20]([F:23])[cH:21][cH:22]3)[C:13]([CH3:24])([c:25]3[cH:26][cH:27][c:28]([F:31])[cH:29][cH:30]3)[N:12]2[C:32](=[O:33])[Cl:34])[cH:9][cH:10]1.[CH3:40][S:41](=[O:42])(=[O:43])[CH2:44][CH2:45][CH2:46][N:47]1[CH2:48][CH2:49][NH:50][CH2:51][CH2:52]1.[ClH:38].[ClH:39]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]([O:35][CH2:36][CH3:37])[c:8]([C:11]2=[N:15][C:14]([CH3:16])([c:17]3[cH:18][cH:19][c:20]([F:23])[cH:21][cH:22]3)[C:13]([CH3:24])([c:25]3[cH:26][cH:27][c:28]([F:31])[cH:29][cH:30]3)[N:12]2[C:32](=[O:33])[N:50]2[CH2:49][CH2:48][N:47]([CH2:46][CH2:45][CH2:44][S:41]([CH3:40])(=[O:42])=[O:43])[CH2:52][CH2:51]2)[cH:9][cH:10]1Participants
4
Sources & evidence
- ORD record
- ord-8d0aa936375e4138a2e2f3b161f008fa
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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