Chloride → 1-t-Butylazo-1-isothiocyanatocyclohexane
Reaction equation
[C:5]([CH3:6])([CH3:7])([CH3:8])[N:9]=[N:10][C:11]1([Cl:17])[CH2:12][CH2:13][CH2:14][CH2:15][CH2:16]1.[CH:21]([OH:22])([CH3:23])[CH3:24].[Cl-:20].[Na+:19].[Na+:1].[OH2:18].[S-:2][C:3]#[N:4]>>[S:2]=[C:3]=[N:4][C:11]1([N:10]=[N:9][C:5]([CH3:6])([CH3:7])[CH3:8])[CH2:12][CH2:13][CH2:14][CH2:15][CH2:16]1Participants
7
Sources & evidence
- ORD record
- ord-a62d3425c31f4c61b5e1f21881b431a9
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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