1,4-Dioxane → 3-{6-[(2,2-Dimethyl-propyl)-methyl-amino]-5-nitro-pyrimidin-4-ylamino}-4,N-dimethyl-benzamide
Reaction equation
[CH:30]([N:31]([CH2:32][CH3:33])[CH:34]([CH3:35])[CH3:36])([CH3:37])[CH3:38].[Cl:1][c:2]1[c:3]([N+:15](=[O:16])[O-:17])[c:4]([N:8]([CH3:9])[CH2:10][C:11]([CH3:12])([CH3:13])[CH3:14])[n:5][cH:6][n:7]1.[NH2:18][c:19]1[cH:20][c:21]([C:22](=[O:23])[NH:24][CH3:25])[cH:26][cH:27][c:28]1[CH3:29].[O:39]1[CH2:40][CH2:41][O:42][CH2:43][CH2:44]1>>[c:2]1([NH:18][c:19]2[cH:20][c:21]([C:22](=[O:23])[NH:24][CH3:25])[cH:26][cH:27][c:28]2[CH3:29])[c:3]([N+:15](=[O:16])[O-:17])[c:4]([N:8]([CH3:9])[CH2:10][C:11]([CH3:12])([CH3:13])[CH3:14])[n:5][cH:6][n:7]1Participants
5
Reactant 4
Product 1
Sources & evidence
- ORD record
- ord-5186357af6ba4903a9c0fc162e7e3b71
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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