Chloride → HCID 72335672, compound
Reaction equation
[CH2:37]([CH2:38][c:39]1[cH:40][cH:41][cH:42][cH:43][cH:44]1)[c:45]1[n:46][c:47]([C:56]([F:57])([F:58])[F:59])[cH:48][cH:49][c:50]1[CH:51]=[CH:52][C:53](=[O:54])[OH:55].[CH3:20][O:21][c:22]1[n:23][c:24]([O:25][CH3:26])[n:27][c:28]([N+:29]2([CH3:30])[CH2:31][CH2:32][O:33][CH2:34][CH2:35]2)[n:36]1.[Cl-:19].[ClH:17].[NH2:1][CH2:2][c:3]1[cH:4][cH:5][c:6]([NH:9][S:10](=[O:11])(=[O:12])[C:13]([F:14])([F:15])[F:16])[cH:7][cH:8]1.[OH2:18]>>[NH:1]([CH2:2][c:3]1[cH:4][cH:5][c:6]([NH:9][S:10](=[O:11])(=[O:12])[C:13]([F:14])([F:15])[F:16])[cH:7][cH:8]1)[C:53]([CH:52]=[CH:51][c:50]1[c:45]([CH2:37][CH2:38][c:39]2[cH:40][cH:41][cH:42][cH:43][cH:44]2)[n:46][c:47]([C:56]([F:57])([F:58])[F:59])[cH:48][cH:49]1)=[O:54]Participants
7
Sources & evidence
- ORD record
- ord-d94ea51f16644da091af91bd90cf6b1a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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