Bicarbonate Ion → 6-cyano-N-[6-(3-{[3-(1-cyanocyclopropyl)benzoyl]amino}phenoxy)imidazo[1,2-b]pyridazin-2-yl]nicotinamide
Reaction equation
[C-:128]#[N:129].[C-:131]#[N:132].[CH3:46][N:47]([CH3:48])[CH:49]=[O:50].[Cl:1][c:2]1[n:3][cH:4][c:5]([C:6](=[O:7])[NH:8][c:9]2[n:10][c:11]3[n:12]([n:13][c:14]([O:17][c:18]4[cH:19][c:20]([NH:24][C:25]([c:26]5[cH:27][c:28]([C:32]6([C:35]#[N:36])[CH2:33][CH2:34]6)[cH:29][cH:30][cH:31]5)=[O:37])[cH:21][cH:22][cH:23]4)[cH:15][cH:16]3)[cH:38]2)[cH:39][cH:40]1.[Na+:41].[OH:42][C:43](=[O:44])[O-:45].[Zn+2:130].[cH:51]1[cH:52][cH:53][c:54]([P:55]([Pd:56]([P:57]([c:58]2[cH:59][cH:60][cH:61][cH:62][cH:63]2)([c:64]2[cH:65][cH:66][cH:67][cH:68][cH:69]2)[c:70]2[cH:71][cH:72][cH:73][cH:74][cH:75]2)([P:76]([c:77]2[cH:78][cH:79][cH:80][cH:81][cH:82]2)([c:83]2[cH:84][cH:85][cH:86][cH:87][cH:88]2)[c:89]2[cH:90][cH:91][cH:92][cH:93][cH:94]2)[P:95]([c:96]2[cH:97][cH:98][cH:99][cH:100][cH:101]2)([c:102]2[cH:103][cH:104][cH:105][cH:106][cH:107]2)[c:108]2[cH:109][cH:110][cH:111][cH:112][cH:113]2)([c:114]2[cH:115][cH:116][cH:117][cH:118][cH:119]2)[c:120]2[cH:121][cH:122][cH:123][cH:124][cH:125]2)[cH:126][cH:127]1>>[c:2]1([C:46]#[N:47])[n:3][cH:4][c:5]([C:6](=[O:7])[NH:8][c:9]2[n:10][c:11]3[n:12]([n:13][c:14]([O:17][c:18]4[cH:19][c:20]([NH:24][C:25]([c:26]5[cH:27][c:28]([C:32]6([C:35]#[N:36])[CH2:33][CH2:34]6)[cH:29][cH:30][cH:31]5)=[O:37])[cH:21][cH:22][cH:23]4)[cH:15][cH:16]3)[cH:38]2)[cH:39][cH:40]1Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-2df28237203046b99c50c0f4a5a751d7
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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