Dimethylformamide → N-(2-(5-chloro-2-(triethylsilyl)-1H-pyrrolo[2,3-b]pyridin-3-yl)ethyl)-5-(2,5-difluorobenzyl)isoxazole-3-carboxamide

HRID 293382Notes

Reaction equation

HRID 293382 reaction equation
[CH:62]([N:63]([CH2:64][CH3:65])[CH:66]([CH3:67])[CH3:68])([CH3:69])[CH3:70].[Cl:1][c:2]1[cH:3][c:4]2[c:5]([n:6][cH:7]1)[nH:8][c:9]([Si:14]([CH2:15][CH3:16])([CH2:17][CH3:18])[CH2:19][CH3:20])[c:10]2[CH2:11][CH2:12][NH2:13].[F:21][c:22]1[c:23]([CH2:24][c:25]2[cH:26][c:27]([C:30](=[O:31])[OH:32])[n:28][o:29]2)[cH:33][c:34]([F:37])[cH:35][cH:36]1.[O:71]=[CH:72][N:73]([CH3:74])[CH3:75].[P-:38]([F:39])([F:40])([F:41])([F:42])([F:43])[F:44].[n:45]1([O:46][C:47]([N:48]([CH3:49])[CH3:50])=[N+:51]([CH3:52])[CH3:53])[c:54]2[n:55][cH:56][cH:57][cH:58][c:59]2[n:60][n:61]1>>[Cl:1][c:2]1[cH:3][c:4]2[c:5]([n:6][cH:7]1)[nH:8][c:9]([Si:14]([CH2:15][CH3:16])([CH2:17][CH3:18])[CH2:19][CH3:20])[c:10]2[CH2:11][CH2:12][NH:13][C:30]([c:27]1[cH:26][c:25]([CH2:24][c:23]2[c:22]([F:21])[cH:36][cH:35][c:34]([F:37])[cH:33]2)[o:29][n:28]1)=[O:31]

Participants

7

Reactant 6

HCID 6228DimethylformamideHCID 9886HexafluorophosphateHCID 81531DiisopropylethylamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 668320395-(2,5-Difluorobenzyl)isoxazole-3-carboxylic acidHCID 668320582-(5-chloro-2-(triethylsilyl)-1H-pyrrolo[2,3-b]pyridin-3-yl)ethanamine

Product 1

HCID 66832015N-(2-(5-chloro-2-(triethylsilyl)-1H-pyrrolo[2,3-b]pyridin-3-yl)ethyl)-5-(2,5-difluorobenzyl)isoxazole-3-carboxamide

Sources & evidence

ORD record
ord-93127d5fd2b84d68ae01532a1264bf92
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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