Dimethyl Sulfide → 4-(6-((4-(Methylsulfonyl)piperazin-1-yl)methyl)-2-(6-phenylpyridin-3-yl)thieno[2,3-d]pyrimidin-4-yl)morpholine

HRID 692257Notes

Reaction equation

HRID 692257 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.[CH3:54][O:55][CH2:56][CH2:57][O:58][CH3:59].[CH3:60][CH2:61][O:62][C:63](=[O:64])[CH3:65].[CH3:66][S:67][CH3:68].[Cu:69][Br:70].[c:29]1(-[c:35]2[n:36][cH:37][c:38]([Sn:41]([CH2:42][CH2:43][CH2:44][CH3:45])([CH2:46][CH2:47][CH2:48][CH3:49])[CH2:50][CH2:51][CH2:52][CH3:53])[cH:39][cH:40]2)[cH:30][cH:31][cH:32][cH:33][cH:34]1.[cH:71]1[cH:72][cH:73][c:74]([P:75]([Pd:76]([P:77]([c:78]2[cH:79][cH:80][cH:81][cH:82][cH:83]2)([c:84]2[cH:85][cH:86][cH:87][cH:88][cH:89]2)[c:90]2[cH:91][cH:92][cH:93][cH:94][cH:95]2)([P:96]([c:97]2[cH:98][cH:99][cH:100][cH:101][cH:102]2)([c:103]2[cH:104][cH:105][cH:106][cH:107][cH:108]2)[c:109]2[cH:110][cH:111][cH:112][cH:113][cH:114]2)[P:115]([c:116]2[cH:117][cH:118][cH:119][cH:120][cH:121]2)([c:122]2[cH:123][cH:124][cH:125][cH:126][cH:127]2)[c:128]2[cH:129][cH:130][cH:131][cH:132][cH:133]2)([c:134]2[cH:135][cH:136][cH:137][cH:138][cH:139]2)[c:140]2[cH:141][cH:142][cH:143][cH:144][cH:145]2)[cH:146][cH:147]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:38]4[cH:37][n:36][c:35](-[c:29]5[cH:30][cH:31][cH:32][cH:33][cH:34]5)[cH:40][cH:39]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]1

Participants

8

Reactant 7

HCID 1068Dimethyl SulfideHCID 80711,2-DimethoxyethaneHCID 8857Ethyl AcetateHCID 24593copper(I) bromideHCID 146900112-Phenyl-5-tributylstannanyl-pyridineHCID 666175866-(4-Methanesulfonyl-piperazin-1-ylmethyl)-2-methylsulfanyl-4-morpholin-4-yl-thieno[2,3-d]pyrimidineHCID 178420554HCID 178420554, compound

Product 1

HCID 249465344-(6-((4-(Methylsulfonyl)piperazin-1-yl)methyl)-2-(6-phenylpyridin-3-yl)thieno[2,3-d]pyrimidin-4-yl)morpholine

Sources & evidence

ORD record
ord-245b6bc45bbd4c0a910b9cea5877788b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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