Acetonitrile → 2-(3-Ethylureido)-5-(trifluoromethyl)benzoic acid
Reaction equation
[CH2:1]([CH3:2])[NH:3][C:4]([NH:5][c:6]1[c:7]([C:8](=[O:9])[O:10][CH2:11][CH:12]=[CH2:13])[cH:14][c:15]([C:18]([F:19])([F:20])[F:21])[cH:16][cH:17]1)=[O:22].[CH2:23]1[CH2:24][NH:25][CH2:26][CH2:27]1.[CH3:28][C:29]#[N:30]>>[CH2:1]([CH3:2])[NH:3][C:4]([NH:5][c:6]1[c:7]([C:8](=[O:9])[OH:10])[cH:14][c:15]([C:18]([F:19])([F:20])[F:21])[cH:16][cH:17]1)=[O:22]Participants
4
Sources & evidence
- ORD record
- ord-cd192c0a3df645b38b79a9b523003542
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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