Ethanol → 4-(4-Methyl-5-(methylthio)-4H-1,2,4-triazol-3-yl)pyridine

Reaction equation

[CH3:18][CH2:19][OH:20].[CH3:1][n:2]1[c:3](=[S:13])[nH:4][n:5][c:6]1-[c:7]1[cH:8][cH:9][n:10][cH:11][cH:12]1.[I:14][CH3:15].[Na+:17].[OH-:16]>>[CH3:1][n:2]1[c:3]([S:13][CH3:15])[n:4][n:5][c:6]1-[c:7]1[cH:8][cH:9][n:10][cH:11][cH:12]1

Participants

Reactant 5

HCID 702Ethanol

HCID 923Sodium Ion

HCID 961Hydroxide

HCID 6328Methyl iodide

HCID 7385474-methyl-5-(pyridin-4-yl)-4H-1,2,4-triazole-3-thiol

Product 1

HCID 8659874-(4-Methyl-5-(methylthio)-4H-1,2,4-triazol-3-yl)pyridine

Sources & evidence

ORD record: ord-ec16661b50394746a4cd3fd10cd46efe
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

Reaction notes

Loading…