Water → HCID 9888229, compound
Reaction equation
[CH3:25][O:26][CH2:27][C:28](=[O:29])[Cl:30].[CH:38]([N:39]([CH:40]([CH3:41])[CH3:42])[CH2:43][CH3:44])([CH3:45])[CH3:46].[NH2:1][CH2:2][CH:3]1[CH2:4][CH2:5][CH:6]([NH:9][c:10]2[s:11][c:12]3[c:13]([n:14]2)-[c:15]2[c:16]([cH:20][cH:21][c:22]([F:24])[cH:23]2)[CH2:17][CH2:18][CH2:19]3)[CH2:7][CH2:8]1.[OH2:31].[cH:32]1[cH:33][cH:34][n:35][cH:36][cH:37]1>>[NH:1]([CH2:2][CH:3]1[CH2:4][CH2:5][CH:6]([NH:9][c:10]2[s:11][c:12]3[c:13]([n:14]2)-[c:15]2[c:16]([cH:20][cH:21][c:22]([F:24])[cH:23]2)[CH2:17][CH2:18][CH2:19]3)[CH2:7][CH2:8]1)[C:28]([CH2:27][O:26][CH3:25])=[O:29]Participants
6
Sources & evidence
- ORD record
- ord-c12fba0c92f34c72af95a6af9867644b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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