Water → HCID 69018943, compound
Reaction equation
[CH2:10]([CH3:11])[O:12][C:13](=[O:14])[c:15]1[n:16]([CH3:41])[c:17]([CH2:39][CH3:40])[c:18]([C:37]#[N:38])[c:19]1-[c:20]1[cH:21][cH:22][c:23]([CH:26]([CH2:27][c:28]2[cH:29][c:30]([C:34]#[N:35])[cH:31][cH:32][cH:33]2)[OH:36])[cH:24][cH:25]1.[CH2:1]([N:2]([S:3]([F:4])([F:5])[F:7])[CH2:6][CH3:8])[CH3:9].[CH2:43]([Cl:44])[Cl:45].[OH2:42]>>[F:7][CH:26]([c:23]1[cH:22][cH:21][c:20](-[c:19]2[c:15]([C:13]([O:12][CH2:10][CH3:11])=[O:14])[n:16]([CH3:41])[c:17]([CH2:39][CH3:40])[c:18]2[C:37]#[N:38])[cH:25][cH:24]1)[CH2:27][c:28]1[cH:29][c:30]([C:34]#[N:35])[cH:31][cH:32][cH:33]1Participants
5
Sources & evidence
- ORD record
- ord-0f549225136643878280e732bdc29a77
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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