Dimethylformamide → (4-Methanesulfonyl-piperazin-1-yl)-{5-[5-(4-methoxy-phenyl)-pyrimidin-2-ylamino]-2-methyl-pyridin-3-yl}-methanone

HRID 674331Notes

Reaction equation

HRID 674331 reaction equation
[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6](-[c:9]2[cH:10][n:11][c:12]([NH:15][c:16]3[cH:17][n:18][c:19]([CH3:25])[c:20]([C:21](=[O:22])[OH:23])[cH:24]3)[n:13][cH:14]2)[cH:7][cH:8]1.[CH3:59][S:60](=[O:61])(=[O:62])[N:63]1[CH2:64][CH2:65][NH:66][CH2:67][CH2:68]1.[CH:50]([N:51]([CH2:52][CH3:53])[CH:54]([CH3:55])[CH3:56])([CH3:57])[CH3:58].[O:69]=[CH:70][N:71]([CH3:72])[CH3:73].[P-:26]([F:27])([F:28])([F:29])([F:30])([F:31])[F:32].[n:33]1([O:34][C:35]([N:36]([CH3:37])[CH3:38])=[N+:39]([CH3:40])[CH3:41])[c:42]2[n:43][cH:44][cH:45][cH:46][c:47]2[n:48][n:49]1>>[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6](-[c:9]2[cH:10][n:11][c:12]([NH:15][c:16]3[cH:17][n:18][c:19]([CH3:25])[c:20]([C:21](=[O:22])[N:66]4[CH2:65][CH2:64][N:63]([S:60]([CH3:59])(=[O:61])=[O:62])[CH2:68][CH2:67]4)[cH:24]3)[n:13][cH:14]2)[cH:7][cH:8]1

Participants

7

Reactant 6

HCID 6228DimethylformamideHCID 9886HexafluorophosphateHCID 81531DiisopropylethylamineHCID 7091611-(Methylsulfonyl)piperazineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 581718975-[5-(4-Methoxy-phenyl)-pyrimidin-2-ylamino]-2-methyl-nicotinic acid

Product 1

HCID 25211540(4-Methanesulfonyl-piperazin-1-yl)-{5-[5-(4-methoxy-phenyl)-pyrimidin-2-ylamino]-2-methyl-pyridin-3-yl}-methanone

Sources & evidence

ORD record
ord-5ea0977d3b5b4ca5a01f5d3cb082cf4b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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