Dimethylformamide → (6-Amino-pyridin-3-yl)-{4-[6-(2-fluoro-4-methanesulfonyl-phenoxy)-5-methyl-pyrimidin-4-yloxy]-piperidin-1-yl}-methanone

HRID 173343Notes

Reaction equation

HRID 173343 reaction equation
[CH3:35][CH2:36][N:37]([CH2:38][CH3:39])[CH2:40][CH3:41].[F:42][c:43]1[c:44]([O:45][c:46]2[n:47][cH:48][n:49][c:50]([O:53][CH:54]3[CH2:55][CH2:56][NH:57][CH2:58][CH2:59]3)[c:51]2[CH3:52])[cH:60][cH:61][c:62]([S:64](=[O:65])(=[O:66])[CH3:67])[cH:63]1.[NH2:1][c:2]1[n:3][cH:4][c:5]([C:6](=[O:7])[OH:8])[cH:9][cH:10]1.[O:68]=[CH:69][N:70]([CH3:71])[CH3:72].[P-:11]([F:12])([F:13])([F:14])([F:15])([F:16])[F:17].[n:18]1([O:19][C:20]([N:21]([CH3:22])[CH3:23])=[N+:24]([CH3:25])[CH3:26])[c:27]2[n:28][cH:29][cH:30][cH:31][c:32]2[n:33][n:34]1>>[NH2:1][c:2]1[n:3][cH:4][c:5]([C:6](=[O:8])[N:57]2[CH2:56][CH2:55][CH:54]([O:53][c:50]3[n:49][cH:48][n:47][c:46]([O:45][c:44]4[c:43]([F:42])[cH:63][c:62]([S:64](=[O:65])(=[O:66])[CH3:67])[cH:61][cH:60]4)[c:51]3[CH3:52])[CH2:59][CH2:58]2)[cH:9][cH:10]1

Participants

7

Reactant 6

HCID 6228DimethylformamideHCID 8471TriethylamineHCID 9886HexafluorophosphateHCID 184966-Aminonicotinic acidHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 672020214-(2-Fluoro-4-methanesulfonyl-phenoxy)-5-methyl-6-(piperidin-4-yloxy)-pyrimidine

Product 1

HCID 11752400(6-Amino-pyridin-3-yl)-{4-[6-(2-fluoro-4-methanesulfonyl-phenoxy)-5-methyl-pyrimidin-4-yloxy]-piperidin-1-yl}-methanone

Sources & evidence

ORD record
ord-2cf1ec449dcb461f857b1c6ed742c149
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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