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Sodium Ion → Methyl 2-[5-[3-amino-2,6-dioxo-4-(trifluoromethyl)pyrimidin-1-yl]-2-chloro-4-fluorophenoxy]prop-2-enoate

HRID 282874
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HRID 282874 반응식
[Cl:1][c:2]1[cH:3][c:4]([F:27])[c:5](-[n:15]2[c:16](=[O:26])[nH:17][c:18]([C:22]([F:23])([F:24])[F:25])[cH:19][c:20]2=[O:21])[cH:6][c:7]1[O:8][C:9](=[CH2:10])[C:11](=[O:12])[O:13][CH3:14].[H-:28].[N+:30]([c:31]1[cH:32][c:33]([N+:34]([O-:35])=[O:36])[cH:37][cH:38][c:39]1[O:40][NH2:41])([O-:42])=[O:43].[Na+:29].[O:44]=[CH:45][N:46]([CH3:47])[CH3:48]>>[Cl:1][c:2]1[cH:3][c:4]([F:27])[c:5](-[n:15]2[c:16](=[O:26])[n:17]([NH2:30])[c:18]([C:22]([F:23])([F:24])[F:25])[cH:19][c:20]2=[O:21])[cH:6][c:7]1[O:8][C:9](=[CH2:10])[C:11](=[O:12])[O:13][CH3:14]
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반응물 5

HCID 923Sodium IonHCID 6228DimethylformamideHCID 87140O-(2,4-dinitrophenyl)hydroxylamineHCID 166653HydrideHCID 70025107methyl 2-[2-chloro-5-[2,4-dioxo-6-(trifluoromethyl)-1H-pyrimidin-3-yl]-4-fluorophenoxy]prop-2-enoate

생성물 1

HCID 86758860
Methyl 2-[5-[3-amino-2,6-dioxo-4-(trifluoromethyl)pyrimidin-1-yl]-2-chloro-4-fluorophenoxy]prop-2-enoate

출처 및 근거

ORD 기록
ord-43298e9e22c54b6dbef63fcc4c921159
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

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