Ethanol → 4-Amino-3-({1-[trans-4-(ethyloxy)cyclohexyl]-4-piperidinyl}amino)benzonitrile
Reaction equation
[CH2:1]([CH3:2])[O:3][CH:4]1[CH2:5][CH2:6][CH:7]([N:10]2[CH2:11][CH2:12][CH:13]([NH:16][c:17]3[cH:18][c:19]([C:20]#[N:21])[cH:22][cH:23][c:24]3[N+:25]([O-:26])=[O:27])[CH2:14][CH2:15]2)[CH2:8][CH2:9]1.[CH3:28][CH2:29][OH:30].[Fe:32].[OH2:31]>>[CH2:1]([CH3:2])[O:3][CH:4]1[CH2:5][CH2:6][CH:7]([N:10]2[CH2:11][CH2:12][CH:13]([NH:16][c:17]3[cH:18][c:19]([C:20]#[N:21])[cH:22][cH:23][c:24]3[NH2:25])[CH2:14][CH2:15]2)[CH2:8][CH2:9]1Participants
5
Sources & evidence
- ORD record
- ord-fc0d5b6b456a45b2b273dc2335c351a7
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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