6-bromo-N-isopropylphthalazin-1-amine → N-(1-Ethyl-1H-pyrazol-5-yl)-3-(1-(isopropylamino)phthalazin-6-yl)-4-methylbenzamide
Reaction equation
[Br:1][c:2]1[cH:3][c:4]2[cH:5][n:6][n:7][c:8]([NH:12][CH:13]([CH3:14])[CH3:15])[c:9]2[cH:10][cH:11]1.[CH2:16]([CH3:17])[n:18]1[n:19][cH:20][cH:21][c:22]1[NH:23][C:24]([c:25]1[cH:26][c:27]([B:32]2[O:33][C:34]([CH3:35])([CH3:36])[C:37]([CH3:38])([CH3:39])[O:40]2)[c:28]([CH3:31])[cH:29][cH:30]1)=[O:41].[cH:42]1[cH:43][cH:44][c:45]([P:46]([Pd:47]([P:48]([c:49]2[cH:50][cH:51][cH:52][cH:53][cH:54]2)([c:55]2[cH:56][cH:57][cH:58][cH:59][cH:60]2)[c:61]2[cH:62][cH:63][cH:64][cH:65][cH:66]2)([P:67]([c:68]2[cH:69][cH:70][cH:71][cH:72][cH:73]2)([c:74]2[cH:75][cH:76][cH:77][cH:78][cH:79]2)[c:80]2[cH:81][cH:82][cH:83][cH:84][cH:85]2)[P:86]([c:87]2[cH:88][cH:89][cH:90][cH:91][cH:92]2)([c:93]2[cH:94][cH:95][cH:96][cH:97][cH:98]2)[c:99]2[cH:100][cH:101][cH:102][cH:103][cH:104]2)([c:105]2[cH:106][cH:107][cH:108][cH:109][cH:110]2)[c:111]2[cH:112][cH:113][cH:114][cH:115][cH:116]2)[cH:117][cH:118]1>>[c:2]1(-[c:27]2[cH:26][c:25]([C:24]([NH:23][c:22]3[n:18]([CH2:16][CH3:17])[n:19][cH:20][cH:21]3)=[O:41])[cH:30][cH:29][c:28]2[CH3:31])[cH:3][c:4]2[cH:5][n:6][n:7][c:8]([NH:12][CH:13]([CH3:14])[CH3:15])[c:9]2[cH:10][cH:11]1Participants
4
Reactant 3
Product 1
Sources & evidence
- ORD record
- ord-5bb66a79222148188b16357d191028e7
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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