Water → HCID 22729929, compound
Reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]1[CH2:9][CH2:10][C:11]([c:14]2[cH:15][c:16]([O:20][CH3:21])[cH:17][cH:18][cH:19]2)([c:22]2[cH:23][cH:24][c:25]([C:26]([NH:27][CH3:28])=[O:29])[cH:30][cH:31]2)[CH2:12][CH2:13]1.[Cl:59][CH2:60][Cl:61].[F:38][C:39]([S:40]([O:41][S:42]([C:43]([F:44])([F:45])[F:46])(=[O:47])=[O:48])(=[O:49])=[O:50])([F:51])[F:52].[NH2:53][C:54]([CH2:55][OH:56])([CH3:57])[CH3:58].[OH2:62].[cH:32]1[cH:33][cH:34][n:35][cH:36][cH:37]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]1[CH2:9][CH2:10][C:11]([c:14]2[cH:15][c:16]([O:20][CH3:21])[cH:17][cH:18][cH:19]2)([c:22]2[cH:23][cH:24][c:25]([C:26]3=[N:53][C:54]([CH3:57])([CH3:58])[CH2:55][O:56]3)[cH:30][cH:31]2)[CH2:12][CH2:13]1Participants
7
Sources & evidence
- ORD record
- ord-4edebeea87dd4fa9af1f3878441c770c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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