Sodium ion → 7-(1,1-Dimethylethyl)-6-((1-ethyl-1H-1,2,4-triazol-5-yl)methoxy)-3-(2-fluorophenyl)-1,2,4-triazolo(4,3-b)pyridazine

HRID 2133219Notes

Reaction equation

HRID 2133219 reaction equation
[CH2:1]([CH3:2])[n:3]1[n:4][cH:5][n:6][c:7]1[CH2:8][OH:9].[Cl:10][c:11]1[c:12]([C:27]([CH3:28])([CH3:29])[CH3:30])[cH:13][c:14]2[n:15]([n:16]1)[c:17](-[c:20]1[c:21]([F:26])[cH:22][cH:23][cH:24][cH:25]1)[n:18][n:19]2.[H-:31].[Na+:32].[O:33]=[CH:34][N:35]([CH3:36])[CH3:37].[OH2:38]>>[CH2:1]([CH3:2])[n:3]1[n:4][cH:5][n:6][c:7]1[CH2:8][O:9][c:11]1[c:12]([C:27]([CH3:28])([CH3:29])[CH3:30])[cH:13][c:14]2[n:15]([n:16]1)[c:17](-[c:20]1[c:21]([F:26])[cH:22][cH:23][cH:24][cH:25]1)[n:18][n:19]2

Participants

7

Reactant 6

HCID 923Sodium ionHCID 962WaterHCID 6228DimethylformamideHCID 166653HydrideHCID 111508847-Tert-butyl-6-chloro-3-(2-fluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazineHCID 11412385(1-ethyl-1H-1,2,4-triazol-5-yl)methanol

Product 1

HCID 99086847-(1,1-Dimethylethyl)-6-((1-ethyl-1H-1,2,4-triazol-5-yl)methoxy)-3-(2-fluorophenyl)-1,2,4-triazolo(4,3-b)pyridazine

Sources & evidence

ORD record
ord-0fca6d9e62de4040984652846c99c588
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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