Toluene → 3,4,5-Trimethoxyphenyl isothiocyanate
Reaction equation
[CH3:18][CH2:19][N:20]([CH2:21][CH3:22])[CH2:23][CH3:24].[CH3:1][O:2][c:3]1[cH:4][c:5]([NH2:6])[cH:7][c:8]([O:12][CH3:13])[c:9]1[O:10][CH3:11].[CH3:25][c:26]1[cH:27][cH:28][cH:29][cH:30][cH:31]1.[Cl:14][C:15]([Cl:16])=[S:17]>>[CH3:1][O:2][c:3]1[cH:4][c:5]([N:6]=[C:15]=[S:17])[cH:7][c:8]([O:12][CH3:13])[c:9]1[O:10][CH3:11]Participants
5
Sources & evidence
- ORD record
- ord-2acda78221094ffa98be1d936afe5986
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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