Water → 2-(2-Methoxy-ethoxy)-6-methylamino-5-nitro-N-(trans-4-trifluoromethyl-cyclohexyl)-nicotinamide
Reaction equation
[CH2:31]1[O:32][CH2:33][CH2:34][CH2:35]1.[CH3:1][NH2:2].[Cl:3][c:4]1[n:5][c:6]([O:26][CH2:27][CH2:28][O:29][CH3:30])[c:7]([C:8](=[O:9])[NH:10][CH:11]2[CH2:12][CH2:13][CH:14]([C:17]([F:18])([F:19])[F:20])[CH2:15][CH2:16]2)[cH:21][c:22]1[N+:23](=[O:24])[O-:25].[OH2:36]>>[CH3:1][NH:2][c:4]1[n:5][c:6]([O:26][CH2:27][CH2:28][O:29][CH3:30])[c:7]([C:8](=[O:9])[NH:10][CH:11]2[CH2:12][CH2:13][CH:14]([C:17]([F:18])([F:19])[F:20])[CH2:15][CH2:16]2)[cH:21][c:22]1[N+:23](=[O:24])[O-:25]Participants
5
Sources & evidence
- ORD record
- ord-99d9f1a263304f7cb4faab97357029b2
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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