Citric Acid → 5-Bromo-4-methyl-2-(5-methyl-1,1-dioxido-1,2,5-thiadiazolidin-2-yl)-pyrimidine

HRID 949184Notes

Reaction equation

HRID 949184 reaction equation
[Br:11][c:12]1[n:13][cH:14][c:15]([Br:19])[c:16]([CH3:18])[n:17]1.[CH2:33]1[O:34][CH2:35][CH2:36][CH2:37]1.[CH3:3][N:4]1[S:5](=[O:9])(=[O:10])[NH:6][CH2:7][CH2:8]1.[H-:1].[Na+:2].[O:38]=[CH:39][N:40]([CH3:41])[CH3:42].[OH2:43].[OH:20][C:21]([CH2:22][C:23]([C:24](=[O:25])[OH:26])([CH2:27][C:28](=[O:29])[OH:30])[OH:31])=[O:32]>>[CH3:3][N:4]1[S:5](=[O:9])(=[O:10])[N:6]([c:12]2[n:13][cH:14][c:15]([Br:19])[c:16]([CH3:18])[n:17]2)[CH2:7][CH2:8]1

Participants

9

Reactant 8

HCID 311Citric AcidHCID 923Sodium ionHCID 962WaterHCID 6228DimethylformamideHCID 8028TetrahydrofuranHCID 166653HydrideHCID 103932802-Methyl-1,2,5-thiadiazolidine 1,1-dioxideHCID 665213222,5-Dibromo-4-methylpyrimidine

Product 1

HCID 672798265-Bromo-4-methyl-2-(5-methyl-1,1-dioxido-1,2,5-thiadiazolidin-2-yl)-pyrimidine

Sources & evidence

ORD record
ord-7c67335933284143ac60930e5e14a82d
Source dataset
Validation data from https://doi.org/10.1039/C8SC04228D

Reaction notes

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