Acetone → [3-[3-(1-Piperidinylmethyl)phenoxy]propyl]isothiocyanate
Reaction equation
[CH3:22][CH2:23][N:24]([CH2:25][CH3:26])[CH2:27][CH3:28].[CH3:29][C:30](=[O:31])[CH3:32].[Cl:33][Hg:34][Cl:35].[N:4]1([CH2:10][c:11]2[cH:12][c:13]([O:14][CH2:15][CH2:16][CH2:17][NH2:18])[cH:19][cH:20][cH:21]2)[CH2:5][CH2:6][CH2:7][CH2:8][CH2:9]1.[S:1]=[C:2]=[S:3]>>[C:2](=[S:3])=[N:18][CH2:17][CH2:16][CH2:15][O:14][c:13]1[cH:12][c:11]([CH2:10][N:4]2[CH2:5][CH2:6][CH2:7][CH2:8][CH2:9]2)[cH:21][cH:20][cH:19]1Participants
6
Sources & evidence
- ORD record
- ord-a5add2c6efe748faa12d5fe8822474d1
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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