Ethanol → 1H-1,2,4-Triazole, 4-methyl-3-(methylthio)-5-phenyl-

Reaction equation

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

Participants

Reactant 5

HCID 702Ethanol

HCID 923Sodium Ion

HCID 961Hydroxide

HCID 6328Methyl iodide

HCID 7197994-methyl-5-phenyl-4H-1,2,4-triazole-3-thiol

Product 1

HCID 2132261H-1,2,4-Triazole, 4-methyl-3-(methylthio)-5-phenyl-

Sources & evidence

ORD record: ord-c7cecc1184c044c9af350ddcaf33f147
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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