Ethanol → 1-Tert-butyl-2-sec-butyl-4-(2-methylphenyl)-5-aminopyrazolin-3-one
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[N:5]1[NH:6][C:7](=[O:18])[CH:8]([c:11]2[c:12]([CH3:17])[cH:13][cH:14][cH:15][cH:16]2)[CH:9]1[NH2:10].[C:24](=[O:25])([O-:26])[O-:27].[CH3:30][CH2:31][OH:32].[I:19][CH:20]([CH3:21])[CH2:22][CH3:23].[K+:28].[K+:29]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[N:5]1[N:6]([CH:20]([CH3:21])[CH2:22][CH3:23])[C:7](=[O:18])[CH:8]([c:11]2[c:12]([CH3:17])[cH:13][cH:14][cH:15][cH:16]2)[CH:9]1[NH2:10]Participants
6
Sources & evidence
- ORD record
- ord-e4d7e4bf959d4072b3adf2cddf0ebab2
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
Loading…