Isopropanol → Methyl 3-(2,3-dihydroxypropyl)amino-2-[3-chloro-6-(methylcarbonyl)amino-5-nitropyrazin-2-yl]-2-butenoate
Reaction equation
[CH3:33][CH2:34][N:35]([CH2:36][CH3:37])[CH2:38][CH3:39].[CH:1]([OH:2])([CH3:3])[CH3:4].[Cl:5][c:6]1[n:7][c:8]([N+:17](=[O:18])[O-:19])[c:9]([NH:13][C:14]([CH3:15])=[O:16])[n:10][c:11]1[Cl:12].[OH:20][CH:21]([CH2:22][NH:23][C:24](=[CH:25][C:26](=[O:27])[O:28][CH3:29])[CH3:30])[CH2:31][OH:32]>>[Cl:5][c:6]1[n:7][c:8]([N+:17](=[O:18])[O-:19])[c:9]([NH:13][C:14]([CH3:15])=[O:16])[n:10][c:11]1[C:25](=[C:24]([NH:23][CH2:22][CH:21]([OH:20])[CH2:31][OH:32])[CH3:30])[C:26](=[O:27])[O:28][CH3:29]Participants
5
Sources & evidence
- ORD record
- ord-e2a1cbad18cb4ff48b150aea6f652122
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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