Pyridine → 4-(2,2-Dimethylbutanoyl)-3-[4-(2,2,2-trifluoroethoxy)pyridin-2-yl]-1,2,4-oxadiazol-5-one

HRID 309628

Reaction equation

HRID 309628 reaction equation
[CH3:30][C:31]([C:32](=[O:33])[Cl:34])([CH2:35][CH3:36])[CH3:37].[F:12][C:13]([CH2:14][O:15][c:16]1[cH:17][c:18](-[c:22]2[nH:23][o:24][c:25](=[O:27])[n:26]2)[n:19][cH:20][cH:21]1)([F:28])[F:29].[N:1]12[CH2:2][CH2:3][CH2:4][N:5]=[C:6]1[CH2:7][CH2:8][CH2:9][CH2:10][CH2:11]2.[cH:38]1[cH:39][cH:40][n:41][cH:42][cH:43]1>>[F:12][C:13]([CH2:14][O:15][c:16]1[cH:17][c:18](-[c:22]2[n:23][o:24][c:25](=[O:27])[n:26]2[C:32]([C:31]([CH3:30])([CH2:35][CH3:36])[CH3:37])=[O:33])[n:19][cH:20][cH:21]1)([F:28])[F:29]

Participants

5

Reactant 4

HCID 1049PyridineHCID 799582,2-Dimethylbutyryl chlorideHCID 811841,8-Diazabicyclo(5.4.0)undec-7-eneHCID 178517546HCID 178517546, compound

Product 1

HCID 595703914-(2,2-Dimethylbutanoyl)-3-[4-(2,2,2-trifluoroethoxy)pyridin-2-yl]-1,2,4-oxadiazol-5-one

Sources & evidence

ORD record
ord-e0ec690fed4b46b8874579297cdaa848
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Linked notes

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