Sodium ion → Methyl 2-[2-(3-butyl-5-methyl-1,2-oxazol-4-yl)ethenyl]-4-methyl-1,3-thiazole-5-carboxylate

HRID 678825Notes

Reaction equation

HRID 678825 reaction equation
[CH3:31][CH2:32][O:33][C:34](=[O:35])[CH3:36].[CH3:6][O:7][C:8](=[O:9])[c:10]1[c:11]([CH3:28])[n:12][c:13]([CH2:15][CH:16]([OH:17])[c:18]2[c:19]([CH2:24][CH2:25][CH2:26][CH3:27])[n:20][o:21][c:22]2[CH3:23])[s:14]1.[Na+:30].[OH-:29].[S:1](=[O:2])(=[O:3])([OH:4])[OH:5]>>[CH3:6][O:7][C:8](=[O:9])[c:10]1[c:11]([CH3:28])[n:12][c:13]([CH:15]=[CH:16][c:18]2[c:19]([CH2:24][CH2:25][CH2:26][CH3:27])[n:20][o:21][c:22]2[CH3:23])[s:14]1

Participants

6

Reactant 5

HCID 923Sodium ionHCID 961HydroxideHCID 1118Sulfuric AcidHCID 8857Ethyl AcetateHCID 666436972-[2-(3-Butyl-5-methyl-isoxazol-4-yl)-2-hydroxy-ethyl]-4-methyl-thiazole-5-carboxylic acid methyl ester

Product 1

HCID 66643652Methyl 2-[2-(3-butyl-5-methyl-1,2-oxazol-4-yl)ethenyl]-4-methyl-1,3-thiazole-5-carboxylate

Sources & evidence

ORD record
ord-f6826349e31f46a19933c47d0d626826
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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