2-Methyl-3-oxo-3-(phenylamino)propanoic acid → N1-(3-Fluoro-4-(2-(1-methyl-1H-imidazol-2-yl)thieno[3,2-b]pyridin-7-yloxy)phenyl)-2-methyl-N3-phenylmalonamide

HRID 1572832Notes

Reaction equation

HRID 1572832 reaction equation
[CH3:63][O:64][c:65]1[cH:66][cH:67][cH:68][cH:69][c:70]1[NH:71][C:72](=[O:73])[CH2:74][C:75]([OH:76])=[O:77].[CH3:78][CH:79]([C:80](=[O:81])[OH:82])[C:83]([NH:84][c:85]1[cH:86][cH:87][cH:88][cH:89][cH:90]1)=[O:91].[F:1][c:2]1[cH:3][c:4]([NH2:24])[cH:5][cH:6][c:7]1[O:8][c:9]1[c:10]2[c:11]([n:12][cH:13][cH:14]1)[cH:15][c:16](-[c:18]1[n:19]([CH3:23])[cH:20][cH:21][n:22]1)[s:17]2.[F:25][c:26]1[cH:27][c:28]([NH:29][C:30](=[O:31])[CH2:32][C:33]([NH:34][c:35]2[cH:36][cH:37][cH:38][cH:39][c:40]2[O:41][CH3:42])=[O:43])[cH:44][cH:45][c:46]1[O:47][c:48]1[cH:49][cH:50][n:51][c:52]2[cH:53][c:54](-[c:55]3[n:56]([CH3:57])[cH:58][cH:59][n:60]3)[s:61][c:62]12>>[F:1][c:2]1[cH:3][c:4]([NH:24][C:80]([CH:79]([CH3:78])[C:83]([NH:84][c:85]2[cH:86][cH:87][cH:88][cH:89][cH:90]2)=[O:91])=[O:81])[cH:5][cH:6][c:7]1[O:8][c:9]1[c:10]2[c:11]([n:12][cH:13][cH:14]1)[cH:15][c:16](-[c:18]1[n:19]([CH3:23])[cH:20][cH:21][n:22]1)[s:17]2

Participants

5

Reactant 4

HCID 126058802-Methyl-3-oxo-3-(phenylamino)propanoic acidHCID 12664594N-(2-Methoxy-phenyl)-malonamic acidHCID 16040869N1-(3-Fluoro-4-(2-(1-methyl-1H-imidazol-2-yl)thieno[3,2-b]pyridin-7-yloxy)phenyl)-N3-(2-methoxyphenyl)malonamideHCID 594244803-Fluoro-4-(2-(1-methyl-1H-imidazol-2-yl)thieno[3,2-b]pyridin-7-yloxy)benzenamine

Product 1

HCID 16041061N1-(3-Fluoro-4-(2-(1-methyl-1H-imidazol-2-yl)thieno[3,2-b]pyridin-7-yloxy)phenyl)-2-methyl-N3-phenylmalonamide

Sources & evidence

ORD record
ord-ccfe357558c24a9e987b91cd7b0caa3b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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