Acetonitrile → Cyclohexyl isothiocyanate
Reaction equation
[CH2:18]([N:19]([CH2:20][CH3:21])[CH2:22][CH3:23])[CH3:24].[CH3:35][C:36]#[N:37].[CH3:8][CH2:9][N:10]([CH2:11][CH3:12])[CH2:13][CH3:14].[CH:25]1([NH:31][C:32]([SH:33])=[S:34])[CH2:26][CH2:27][CH2:28][CH2:29][CH2:30]1.[NH2:1][CH:2]1[CH2:3][CH2:4][CH2:5][CH2:6][CH2:7]1.[S:15]=[C:16]=[S:17]>>[CH:25]1([N:31]=[C:32]=[S:33])[CH2:26][CH2:27][CH2:28][CH2:29][CH2:30]1Participants
6
Sources & evidence
- ORD record
- ord-2db8caac491c4fadab8f9ae6f247e3be
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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