Water → 3-[3-(2-Bromo-2-ethylthioethoxycarbonylethenyl)-4-chlorophenyl]-2,4-dioxo-1-methyl-6-trifluoromethyl-1,2,3,4-tetrahydropyrimidine

HRID 91409

Reaction equation

HRID 91409 reaction equation
[Br:1][C:2](=[CH:3][c:4]1[cH:5][c:6](-[n:11]2[c:12](=[O:23])[n:13]([CH3:22])[c:14]([C:18]([F:19])([F:20])[F:21])[cH:15][c:16]2=[O:17])[cH:7][cH:8][c:9]1[Cl:10])[C:24](=[O:25])[Cl:26].[CH2:27]([CH3:28])[S:29][CH2:30][CH2:31][OH:32].[CH3:33][CH2:34][N:35]([CH2:36][CH3:37])[CH2:38][CH3:39].[O:41]1[CH2:42][CH2:43][CH2:44][CH2:45]1.[OH2:40]>>[Br:1][C:2](=[CH:3][c:4]1[cH:5][c:6](-[n:11]2[c:12](=[O:23])[n:13]([CH3:22])[c:14]([C:18]([F:19])([F:20])[F:21])[cH:15][c:16]2=[O:17])[cH:7][cH:8][c:9]1[Cl:10])[C:24](=[O:25])[O:32][CH2:31][CH2:30][S:29][CH2:27][CH3:28]

Participants

6

Reactant 5

HCID 962WaterHCID 8028TetrahydrofuranHCID 80752-(Ethylthio)ethanolHCID 8471TriethylamineHCID 865837993-[3-(2-Bromo-2-chlorocarbonylethenyl)-4-chlorophenyl]-2,4-dioxo-1-methyl-6-trifluoromethyl-1,2,3,4-tetrahydropyrimidine

Product 1

HCID 865837983-[3-(2-Bromo-2-ethylthioethoxycarbonylethenyl)-4-chlorophenyl]-2,4-dioxo-1-methyl-6-trifluoromethyl-1,2,3,4-tetrahydropyrimidine

Sources & evidence

ORD record
ord-dfda456e4daf47ba972d8eaa449f3160
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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