Water → HCID 58015109, compound
Reaction equation
[CH:51]([OH:52])([CH3:53])[CH3:54].[Cl:1][c:2]1[n:3][cH:4][c:5]2[c:6]([n:22]1)[N:7]([CH:16]1[CH2:17][CH2:18][CH2:19][CH2:20][CH2:21]1)[CH2:8][C:9]([F:14])([F:15])[C:10](=[O:13])[N:11]2[CH3:12].[NH2:35][c:36]1[cH:37][cH:38][c:39]([C:40](=[O:41])[NH:42][CH2:43][CH2:44][CH2:45][N:46]([CH3:47])[CH3:48])[cH:49][cH:50]1.[OH2:23].[c:24]1([CH3:25])[c:26]([S:27]([OH:28])(=[O:29])=[O:30])[cH:31][cH:32][cH:33][cH:34]1>>[c:2]1([NH:35][c:36]2[cH:37][cH:38][c:39]([C:40](=[O:41])[NH:42][CH2:43][CH2:44][CH2:45][N:46]([CH3:47])[CH3:48])[cH:49][cH:50]2)[n:3][cH:4][c:5]2[c:6]([n:22]1)[N:7]([CH:16]1[CH2:17][CH2:18][CH2:19][CH2:20][CH2:21]1)[CH2:8][C:9]([F:14])([F:15])[C:10](=[O:13])[N:11]2[CH3:12]Participants
6
Sources & evidence
- ORD record
- ord-24c285aee5a246449b9a30f111ae73d8
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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