Calcium Cation → 2-Chloro-4-fluoro-5-isothiocyanatothiobenzoic 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:16])[cH:10][c:11]([F:15])[c:12]([NH2:14])[cH:13]1)=[S:17].[Ca+2:18].[Cl:23][C:24]([Cl:25])=[S:26].[Cl:30][CH2:31][Cl:32].[O-:19][C:20](=[O:21])[O-:22].[O:27]=[C:28]=[O:29].[OH2:33]>>[CH3:1][O:2][C:3](=[O:4])[CH2:5][O:6][C:7]([c:8]1[c:9]([Cl:16])[cH:10][c:11]([F:15])[c:12]([N:14]=[C:24]=[S:26])[cH:13]1)=[S:17]Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-9aa86de4296c4d7285a53802795462ad
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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