Acetate → Methyl 4-(8-(3-(trifluoromethyl)phenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-ylamino)benzoate

HRID 146808Notes

Reaction equation

HRID 146808 reaction equation
[C:32](=[O:33])([O-:34])[O-:35].[CH2:38]1[O:39][CH2:40][CH2:41][O:42][CH2:43]1.[Cs+:36].[Cs+:37].[F:1][C:2]([c:3]1[cH:4][c:5](-[c:9]2[c:10]3[n:11]([cH:12][cH:13][cH:14]2)[n:15][c:16]([NH2:18])[n:17]3)[cH:6][cH:7][cH:8]1)([F:19])[F:20].[I:21][c:22]1[cH:23][cH:24][c:25]([C:26](=[O:27])[O:28][CH3:29])[cH:30][cH:31]1.[O-:45][C:46]([CH3:47])=[O:48].[O-:49][C:50]([CH3:51])=[O:52].[Pd+2:44]>>[F:1][C:2]([c:3]1[cH:4][c:5](-[c:9]2[c:10]3[n:11]([cH:12][cH:13][cH:14]2)[n:15][c:16]([NH:18][c:22]2[cH:23][cH:24][c:25]([C:26](=[O:27])[O:28][CH3:29])[cH:30][cH:31]2)[n:17]3)[cH:6][cH:7][cH:8]1)([F:19])[F:20]

Participants

8

Reactant 7

HCID 175Acetate2×HCID 19660Carbonate IonHCID 312751,4-DioxaneHCID 69273Methyl 4-iodobenzoateHCID 104967Cesium cation2×HCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 591990748-(3-Trifluoromethylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-ylamine

Product 1

HCID 44554495Methyl 4-(8-(3-(trifluoromethyl)phenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-ylamino)benzoate

Sources & evidence

ORD record
ord-b6214e9c29054746832e022a3230cf38
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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