Acetic Acid → 3-{5-[(3-Chloropropyl)thio]-4-methyl-4H-1,2,4-triazol-3-yl}pyridine

HRID 688619Notes

Reaction equation

HRID 688619 reaction equation
[Br:14][CH2:15][CH2:16][CH2:17][Cl:18].[CH3:19][C:20](=[O:21])[OH:22].[CH3:1][n:2]1[c:3](=[S:13])[nH:4][n:5][c:6]1-[c:7]1[cH:8][n:9][cH:10][cH:11][cH:12]1.[CH3:23][CH2:24][OH:25]>>[CH3:1][n:2]1[c:3]([S:13][CH2:15][CH2:16][CH2:17][Cl:18])[n:4][n:5][c:6]1-[c:7]1[cH:8][n:9][cH:10][cH:11][cH:12]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 702EthanolHCID 80061-Bromo-3-chloropropaneHCID 7575824-methyl-5-(pyridin-3-yl)-4H-1,2,4-triazole-3-thiol

Product 1

HCID 534173103-{5-[(3-Chloropropyl)thio]-4-methyl-4H-1,2,4-triazol-3-yl}pyridine

Sources & evidence

ORD record
ord-1b6f90ffa4654645881b495397a6a6fa
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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