Bromide ion → 4-[5-Cyano-6-(6-propyl-pyridin-3-ylamino)-pyrimidin-4-yloxy]-piperidine-1-carboxylic Acid Isopropyl Ester
Reaction equation
[Br-:30].[CH2:112]1[O:113][CH2:114][CH2:115][CH2:116]1.[CH2:31]([CH2:32][CH3:33])[Zn+:34].[CH:1]([CH3:2])([CH3:3])[O:4][C:5](=[O:6])[N:7]1[CH2:8][CH2:9][CH:10]([O:13][c:14]2[n:15][cH:16][n:17][c:18]([NH:22][c:23]3[cH:24][n:25][c:26]([Cl:29])[cH:27][cH:28]3)[c:19]2[C:20]#[N:21])[CH2:11][CH2:12]1.[c:35]1([PH:36]([Pd:37]([PH:38]([c:39]2[cH:40][cH:41][cH:42][cH:43][cH:44]2)([c:45]2[cH:46][cH:47][cH:48][cH:49][cH:50]2)[c:51]2[cH:52][cH:53][cH:54][cH:55][cH:56]2)([PH: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)[PH: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)([c:95]2[cH:96][cH:97][cH:98][cH:99][cH:100]2)[c:101]2[cH:102][cH:103][cH:104][cH:105][cH:106]2)[cH:107][cH:108][cH:109][cH:110][cH:111]1>>[CH:1]([CH3:2])([CH3:3])[O:4][C:5](=[O:6])[N:7]1[CH2:8][CH2:9][CH:10]([O:13][c:14]2[n:15][cH:16][n:17][c:18]([NH:22][c:23]3[cH:24][n:25][c:26]([CH2:31][CH2:32][CH3:33])[cH:27][cH:28]3)[c:19]2[C:20]#[N:21])[CH2:11][CH2:12]1Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-63ea61bf68d44cba863b2cbd406b24d5
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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