Ethanol → 2-(4-((2-(2-Fluorobenzofuran-3-yl)-4-morpholinothieno[3,2-d]pyrimidin-6-yl)methyl)piperazin-1-yl)-2-methylpropanamide

HRID 673564Notes

Reaction equation

HRID 673564 reaction equation
[Br:42][c:43]1[c:44]([F:52])[o:45][c:46]2[c:47]1[cH:48][cH:49][cH:50][cH:51]2.[CH3:1][C:2]([C:3](=[O:4])[NH2:5])([CH3:6])[N:7]1[CH2:8][CH2:9][N:10]([CH2:13][c:14]2[cH:15][c:16]3[n:17][c:18]([Sn:29]([CH2:30][CH2:31][CH2:32][CH3:33])([CH2:34][CH2:35][CH2:36][CH3:37])[CH2:38][CH2:39][CH2:40][CH3:41])[n:19][c:20]([N:23]4[CH2:24][CH2:25][O:26][CH2:27][CH2:28]4)[c:21]3[s:22]2)[CH2:11][CH2:12]1.[CH3:61][CH2:62][OH:63].[Cu+:72].[Na+:54].[O:55]1[CH2:56][CH2:57][O:58][CH2:59][CH2:60]1.[OH-:53].[cH:73]1[cH:74][cH:75][c:76]([P:77]([Pd:78]([P:79]([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)[c:92]2[cH:93][cH:94][cH:95][cH:96][cH:97]2)([P:98]([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)[P:117]([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)[c:142]2[cH:143][cH:144][cH:145][cH:146][cH:147]2)[cH:148][cH:149]1.[s:64]1[cH:65][cH:66][cH:67][c:68]1[C:69]([O-:70])=[O:71]>>[CH3:1][C:2]([C:3](=[O:4])[NH2:5])([CH3:6])[N:7]1[CH2:8][CH2:9][N:10]([CH2:13][c:14]2[cH:15][c:16]3[n:17][c:18](-[c:43]4[c:44]([F:52])[o:45][c:46]5[c:47]4[cH:48][cH:49][cH:50][cH:51]5)[n:19][c:20]([N:23]4[CH2:24][CH2:25][O:26][CH2:27][CH2:28]4)[c:21]3[s:22]2)[CH2:11][CH2:12]1

Participants

10

Reactant 9

HCID 702EthanolHCID 923Sodium ionHCID 961HydroxideHCID 312751,4-DioxaneHCID 104815Copper(1+)HCID 5017639Thiophene-2-carboxylateHCID 575067302-[4-(4-Morpholin-4-yl-2-(tributylstannanyl)-thieno[3,2-d]pyrimidin-6-ylmethyl)piperazin-1-yl]isobutyramideHCID 674926943-Bromo-2-fluorobenzofuranHCID 178420554HCID 178420554, compound

Product 1

HCID 498347552-(4-((2-(2-Fluorobenzofuran-3-yl)-4-morpholinothieno[3,2-d]pyrimidin-6-yl)methyl)piperazin-1-yl)-2-methylpropanamide

Sources & evidence

ORD record
ord-1a31ba48e30e4ce98730c368a38f56d1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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