Dimethyl Sulfide → N-methyl-5-(6-((4-(methylsulfonyl)piperazin-1-yl)methyl)-4-morpholinothieno[2,3-d]pyrimidin-2-yl)pyrimidin-2-amine
Reaction equation
[CH3:1][S:2](=[O:3])(=[O:4])[N:5]1[CH2:6][CH2:7][N:8]([CH2:11][c:12]2[cH:13][c:14]3[c:15]([n:16][c:17]([S:26][CH3:27])[n:18][c:19]3[N:20]3[CH2:21][CH2:22][O:23][CH2:24][CH2:25]3)[s:28]2)[CH2:9][CH2:10]1.[CH3:29][NH:30][c:31]1[n:32][cH:33][c:34]([Sn:37]([CH2:38][CH2:39][CH2:40][CH3:41])([CH2:42][CH2:43][CH2:44][CH3:45])[CH2:46][CH2:47][CH2:48][CH3:49])[cH:35][n:36]1.[CH3:50][O:51][CH2:52][CH2:53][O:54][CH3:55].[CH3:56][CH2:57][O:58][C:59](=[O:60])[CH3:61].[CH3:62][S:63][CH3:64].[Cu:65][Br:66].[cH:67]1[cH:68][cH:69][c:70]([P:71]([Pd:72]([P:73]([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)[c:86]2[cH:87][cH:88][cH:89][cH:90][cH:91]2)([P:92]([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)[P:111]([c:112]2[cH:113][cH:114][cH:115][cH:116][cH:117]2)([c:118]2[cH:119][cH:120][cH:121][cH:122][cH:123]2)[c:124]2[cH:125][cH:126][cH:127][cH:128][cH:129]2)([c:130]2[cH:131][cH:132][cH:133][cH:134][cH:135]2)[c:136]2[cH:137][cH:138][cH:139][cH:140][cH:141]2)[cH:142][cH:143]1>>[CH3:1][S:2](=[O:3])(=[O:4])[N:5]1[CH2:6][CH2:7][N:8]([CH2:11][c:12]2[cH:13][c:14]3[c:15]([n:16][c:17](-[c:34]4[cH:33][n:32][c:31]([NH:30][CH3:29])[n:36][cH:35]4)[n:18][c:19]3[N:20]3[CH2:21][CH2:22][O:23][CH2:24][CH2:25]3)[s:28]2)[CH2:9][CH2:10]1Participants
8
Reactant 7
HCID 1068Dimethyl Sulfide
HCID 80711,2-Dimethoxyethane
HCID 8857Ethyl Acetate
HCID 24593copper(I) bromide
HCID 666175866-(4-Methanesulfonyl-piperazin-1-ylmethyl)-2-methylsulfanyl-4-morpholin-4-yl-thieno[2,3-d]pyrimidine
HCID 66933863Methyl-(5-tributylstannyl-pyrimidin-2-yl)-amine
HCID 178420554HCID 178420554, compoundProduct 1
Sources & evidence
- ORD record
- ord-f413712fcd304b6bae9540a844db353b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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