Pyridine → 4-(2,2-Dimethylbutanoyl)-3-(4-trifluoromethylpyridin-2-yl)-1,2,4-oxadiazol-5-one

HRID 312737

Reaction equation

HRID 312737 reaction equation
[CH3:28][C:29]([C:30](=[O:31])[Cl:32])([CH2:33][CH3:34])[CH3:35].[F:12][C:13]([c:14]1[cH:15][c:16](-[c:20]2[nH:21][o:22][c:23](=[O:25])[n:24]2)[n:17][cH:18][cH:19]1)([F:26])[F:27].[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:36]1[cH:37][cH:38][n:39][cH:40][cH:41]1>>[F:12][C:13]([c:14]1[cH:15][c:16](-[c:20]2[n:21][o:22][c:23](=[O:25])[n:24]2[C:30]([C:29]([CH3:28])([CH2:33][CH3:34])[CH3:35])=[O:31])[n:17][cH:18][cH:19]1)([F:26])[F:27]

Participants

5

Reactant 4

HCID 1049PyridineHCID 799582,2-Dimethylbutyryl chlorideHCID 811841,8-Diazabicyclo(5.4.0)undec-7-eneHCID 178517507HCID 178517507, compound

Product 1

HCID 595703884-(2,2-Dimethylbutanoyl)-3-(4-trifluoromethylpyridin-2-yl)-1,2,4-oxadiazol-5-one

Sources & evidence

ORD record
ord-015b7cc7744041e5bf683e30b86b1b17
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Linked notes

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