Water → 3-cyclopropyl-N-[3-({2-[(cyclopropylcarbonyl)amino][1,2,4]triazolo[1,5-a]pyridin-6-yl}oxy)phenyl]-1-methyl-1H-pyrazole-4-carboxamide

HRID 315079

Reaction equation

HRID 315079 reaction equation
[CH3:60][N:61]([CH3:62])[CH:63]=[O:64].[CH:13]1([c:14]2[n:15]([CH3:16])[n:17][cH:18][c:19]2[C:20]([OH:21])=[O:22])[CH2:23][CH2:24]1.[CH:1]1([c:4]2[n:5][n:6]([CH3:12])[cH:7][c:8]2[C:9](=[O:10])[OH:11])[CH2:2][CH2:3]1.[Cl:25][C:26]([C:27]([Cl:28])=[O:29])=[O:30].[NH2:31][c:32]1[cH:33][c:34]([O:35][c:36]2[cH:37][cH:38][c:39]3[n:40]([cH:41]2)[n:42][c:43]([NH:45][C:46](=[O:47])[CH:48]2[CH2:49][CH2:50]2)[n:44]3)[cH:51][cH:52][cH:53]1.[O:54]1[CH2:55][CH2:56][CH2:57][CH2:58]1.[OH2:59]>>[CH:1]1([c:4]2[n:5][n:6]([CH3:12])[cH:7][c:8]2[C:9](=[O:11])[NH:31][c:32]2[cH:33][c:34]([O:35][c:36]3[cH:37][cH:38][c:39]4[n:40]([cH:41]3)[n:42][c:43]([NH:45][C:46](=[O:47])[CH:48]3[CH2:49][CH2:50]3)[n:44]4)[cH:51][cH:52][cH:53]2)[CH2:2][CH2:3]1

Participants

8

Reactant 7

HCID 962WaterHCID 6228DimethylformamideHCID 8028TetrahydrofuranHCID 65578Oxalyl chlorideHCID 195767943-cyclopropyl-1-methyl-1H-pyrazole-4-carboxylic acidHCID 290492885-cyclopropyl-1-methyl-1H-pyrazole-4-carboxylic acidHCID 57749117N-[6-(3-aminophenoxy)[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide

Product 1

HCID 577491363-cyclopropyl-N-[3-({2-[(cyclopropylcarbonyl)amino][1,2,4]triazolo[1,5-a]pyridin-6-yl}oxy)phenyl]-1-methyl-1H-pyrazole-4-carboxamide

Sources & evidence

ORD record
ord-98fa54718fd645d39224c59f6e02f63a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Linked notes

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