Dimethylformamide → N-(2-(dimethylamino)ethyl)-5-methyl-4-(2-(tetrahydro-2H-pyran-4-yloxy)pyridin-3-ylamino)thieno[2,3-d]pyrimidine-6-carboxamide

HRID 1134679Notes

Reaction equation

HRID 1134679 reaction equation
[CH3:25][c:26]1[c:27]([C:49](=[O:50])[OH:51])[s:28][c:29]2[n:30][cH:31][n:32][c:33]([NH:35][c:36]3[c:37]([O:42][CH:43]4[CH2:44][CH2:45][O:46][CH2:47][CH2:48]4)[n:38][cH:39][cH:40][cH:41]3)[c:34]12.[CH3:61][N:62]([CH2:63][CH2:64][NH2:65])[CH3:66].[CH:52]([N:53]([CH2:54][CH3:55])[CH:56]([CH3:57])[CH3:58])([CH3:59])[CH3:60].[O:67]=[CH:68][N:69]([CH3:70])[CH3:71].[P-:1]([F:2])([F:3])([F:4])([F:5])([F:6])[F:7].[n:8]1([O:9][C:10]([N:11]([CH3:12])[CH3:13])=[N+:14]([CH3:15])[CH3:16])[c:17]2[n:18][cH:19][cH:20][cH:21][c:22]2[n:23][n:24]1>>[CH3:25][c:26]1[c:27]([C:49](=[O:50])[NH:65][CH2:64][CH2:63][N:62]([CH3:61])[CH3:66])[s:28][c:29]2[n:30][cH:31][n:32][c:33]([NH:35][c:36]3[c:37]([O:42][CH:43]4[CH2:44][CH2:45][O:46][CH2:47][CH2:48]4)[n:38][cH:39][cH:40][cH:41]3)[c:34]12

Participants

7

Reactant 6

HCID 6228DimethylformamideHCID 9886HexafluorophosphateHCID 66053N,N-DimethylethylenediamineHCID 81531DiisopropylethylamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 584131025-methyl-4-(2-(tetrahydro-2H-pyran-4-yloxy)pyridin-3-ylamino)thieno[2,3-d]pyrimidine-6-carboxylic acid

Product 1

HCID 46182129N-(2-(dimethylamino)ethyl)-5-methyl-4-(2-(tetrahydro-2H-pyran-4-yloxy)pyridin-3-ylamino)thieno[2,3-d]pyrimidine-6-carboxamide

Sources & evidence

ORD record
ord-18c7c1adb12b490ba439bced8b372299
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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