Water → HCID 54258996, compound
Reaction equation
[C:38]([C:39]([CH3:40])([CH3:41])[CH3:42])(=[O:43])[Cl:44].[CH2:33]1[O:34][CH2:35][CH2:36][CH2:37]1.[CH3:1][n:2]1[n:3][c:4]([C:22]([F:23])([F:24])[F:25])[c:5]([C:8](=[C:9]([C:10]#[N:11])[c:12]2[s:13][cH:14][c:15]([C:17]([CH3:18])([CH3:19])[CH3:20])[n:16]2)[OH:21])[c:6]1[Cl:7].[CH3:26][CH2:27][N:28]([CH2:29][CH3:30])[CH2:31][CH3:32].[OH2:45]>>[CH3:1][n:2]1[n:3][c:4]([C:22]([F:23])([F:24])[F:25])[c:5]([C:8](=[C:9]([C:10]#[N:11])[c:12]2[s:13][cH:14][c:15]([C:17]([CH3:18])([CH3:19])[CH3:20])[n:16]2)[O:21][C:38]([C:39]([CH3:40])([CH3:41])[CH3:42])=[O:43])[c:6]1[Cl:7]Participants
6
Sources & evidence
- ORD record
- ord-21d80ede145f433681ce4514a0b742f7
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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