Hydrochloric Acid → HCID 19085375, compound
Reaction equation
[CH:44]([Cl:45])([Cl:46])[Cl:47].[Cl:1][c:2]1[c:3]([C:8]2=[N:9][CH2:10][c:11]3[n:12]([c:20]([C:23]([F:24])([F:25])[F:26])[n:21][n:22]3)-[c:13]3[c:14]2[cH:15][c:16]([CH2:18][CH3:19])[s:17]3)[cH:4][cH:5][cH:6][cH:7]1.[Cl:33][c:34]1[cH:35][c:36]([C:37](=[O:38])[Cl:39])[cH:40][cH:41][c:42]1[Cl:43].[ClH:27].[Na+:28].[OH:29][C:30](=[O:31])[O-:32]>>[Cl:1][c:2]1[c:3]([C:8]([c:14]2[c:13](-[n:12]3[c:11]([CH2:10][NH:9][C:37]([c:36]4[cH:35][c:34]([Cl:33])[c:42]([Cl:43])[cH:41][cH:40]4)=[O:38])[n:22][n:21][c:20]3[C:23]([F:24])([F:25])[F:26])[s:17][c:16]([CH2:18][CH3:19])[cH:15]2)=[O:29])[cH:4][cH:5][cH:6][cH:7]1Participants
7
Sources & evidence
- ORD record
- ord-142f6f799986459fb53592bc9bf72099
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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