Methanol → N-[5-({2-[(cyclopropylcarbonyl)amino][1,2,4]triazolo[1,5-a]pyridin-6-yl}oxy)-2-methylphenyl]-2-methyl-5-(trifluoromethyl)-1,3-oxazole-4-carboxamide

HRID 681963Notes

Reaction equation

HRID 681963 reaction equation
[CH3:1][c:2]1[o:3][c:4]([C:10]([F:11])([F:12])[F:13])[c:5]([C:7](=[O:8])[OH:9])[n:6]1.[CH3:56][OH:57].[CH3:58][N:59]([CH3:60])[CH:61]=[O:62].[Cl:14][C:15]([C:16]([Cl:17])=[O:18])=[O:19].[NH2:20][c:21]1[cH:22][c:23]([O:24][c:25]2[cH:26][cH:27][c:28]3[n:29]([cH:30]2)[n:31][c:32]([NH:34][C:35](=[O:36])[CH:37]2[CH2:38][CH2:39]2)[n:33]3)[cH:40][cH:41][c:42]1[CH3:43].[Na+:44].[Na+:45].[O-:46][C:47](=[O:48])[O-:49].[O:50]1[CH2:51][CH2:52][CH2:53][CH2:54]1.[OH2:55]>>[CH3:1][c:2]1[o:3][c:4]([C:10]([F:11])([F:12])[F:13])[c:5]([C:7](=[O:9])[NH:20][c:21]2[cH:22][c:23]([O:24][c:25]3[cH:26][cH:27][c:28]4[n:29]([cH:30]3)[n:31][c:32]([NH:34][C:35](=[O:36])[CH:37]3[CH2:38][CH2:39]3)[n:33]4)[cH:40][cH:41][c:42]2[CH3:43])[n:6]1

Participants

10

Reactant 9

HCID 887MethanolHCID 923Sodium ion2×HCID 962WaterHCID 6228DimethylformamideHCID 8028TetrahydrofuranHCID 19660Carbonate IonHCID 65578Oxalyl chlorideHCID 27756512-methyl-5-(trifluoromethyl)-1,3-oxazole-4-carboxylic AcidHCID 57749401N-[6-(3-amino-4-methylphenoxy)[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide

Product 1

HCID 57749232N-[5-({2-[(cyclopropylcarbonyl)amino][1,2,4]triazolo[1,5-a]pyridin-6-yl}oxy)-2-methylphenyl]-2-methyl-5-(trifluoromethyl)-1,3-oxazole-4-carboxamide

Sources & evidence

ORD record
ord-b64a7775c3154cd19ca8ad44b3552954
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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