Toluene → 2-Chloro-4-fluoro-5-(1-hexahydropyridazinylthiocarbonylamino)-thiobenzoic acid (methoxycarbonylmethyl) ester
Reaction equation
[CH3:1][O:2][C:3](=[O:4])[CH2:5][O:6][C:7]([c:8]1[c:9]([Cl:18])[cH:10][c:11]([F:17])[c:12]([N:14]=[C:15]=[S:16])[cH:13]1)=[S:19].[CH3:26][c:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1.[NH:20]1[NH:21][CH2:22][CH2:23][CH2:24][CH2:25]1>>[CH3:1][O:2][C:3](=[O:4])[CH2:5][O:6][C:7]([c:8]1[c:9]([Cl:18])[cH:10][c:11]([F:17])[c:12]([NH:14][C:15](=[S:16])[N:20]2[NH:21][CH2:22][CH2:23][CH2:24][CH2:25]2)[cH:13]1)=[S:19]Participants
4
Sources & evidence
- ORD record
- ord-e7a74063b3814fa79a8605e98021af12
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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