Ethyl Acetate → 1-[4-(2-Benzimidazolylthio)phenyl]-3-(4-chloro-3-trifluoromethylphenyl)thiourea
Reaction equation
[CH3:34][CH2:35][O:36][C:37](=[O:38])[CH3:39].[Cl:20][c:21]1[c:22]([C:30]([F:31])([F:32])[F:33])[cH:23][c:24]([N:27]=[C:28]=[S:29])[cH:25][cH:26]1.[N+:1]([O-:2])(=[O:3])[c:4]1[cH:5][cH:6][c:7]([S:10][c:11]2[nH:12][c:13]3[c:14]([n:15]2)[cH:16][cH:17][cH:18][cH:19]3)[cH:8][cH:9]1>>[NH:1]([c:4]1[cH:5][cH:6][c:7]([S:10][c:11]2[nH:12][c:13]3[c:14]([n:15]2)[cH:16][cH:17][cH:18][cH:19]3)[cH:8][cH:9]1)[C:28]([NH:27][c:24]1[cH:23][c:22]([C:30]([F:31])([F:32])[F:33])[c:21]([Cl:20])[cH:26][cH:25]1)=[S:29]Participants
4
Sources & evidence
- ORD record
- ord-e1039abaddce4247919534e3ce0ac133
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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