Hydrochloric Acid → 3-{2-Chloro-4-fluoro-5-[3-methyl-2,6-dioxo-4-(trifluoromethyl)-1,2,3,6-tetrahydropyrimidin-1-yl]phenoxy}-2-[(methoxyaminocarbonyl)methoxy]pyridine

HRID 1120745Notes

Reaction equation

HRID 1120745 reaction equation
[CH3:2][N:3]([CH3:4])[CH2:5][CH2:6][CH2:7][N:8]=[C:9]=[N:10][CH2:11][CH3:12].[CH3:47][O:48][NH2:49].[CH3:50][CH2:51][N:52]([CH2:53][CH3:54])[CH2:55][CH3:56].[CH3:58][N:59]([CH3:60])[CH:61]=[O:62].[Cl:13][c:14]1[c:15]([O:16][c:17]2[c:18]([O:23][CH2:24][C:25](=[O:26])[OH:27])[n:19][cH:20][cH:21][cH:22]2)[cH:28][c:29](-[n:33]2[c:34](=[O:45])[n:35]([CH3:44])[c:36]([C:40]([F:41])([F:42])[F:43])[cH:37][c:38]2=[O:39])[c:30]([F:32])[cH:31]1.[ClH:1].[ClH:46].[OH2:57]>>[Cl:13][c:14]1[c:15]([O:16][c:17]2[c:18]([O:23][CH2:24][C:25](=[O:26])[NH:49][O:48][CH3:47])[n:19][cH:20][cH:21][cH:22]2)[cH:28][c:29](-[n:33]2[c:34](=[O:45])[n:35]([CH3:44])[c:36]([C:40]([F:41])([F:42])[F:43])[cH:37][c:38]2=[O:39])[c:30]([F:32])[cH:31]1

Participants

8

Reactant 7

HCID 313Hydrochloric Acid2×HCID 962WaterHCID 4113O-MethylhydroxylamineHCID 6228DimethylformamideHCID 8471TriethylamineHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 219335233-{2-Chloro-4-fluoro-5-[3-methyl-2,6-dioxo-4-(trifluoromethyl)-1,2,3,6-tetrahydropyrimidin-1-yl]phenoxy}-2-carboxymethoxypyridine

Product 1

HCID 219335663-{2-Chloro-4-fluoro-5-[3-methyl-2,6-dioxo-4-(trifluoromethyl)-1,2,3,6-tetrahydropyrimidin-1-yl]phenoxy}-2-[(methoxyaminocarbonyl)methoxy]pyridine

Sources & evidence

ORD record
ord-380d49d894264a5984717f93766d3baa
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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