Tetrahydrofuran → Methyl 2-[4-[3-(4-fluorophenyl)-3-[4-(3-methylsulfanylprop-1-ynyl)phenyl]prop-2-enoxy]-2-methylphenoxy]acetate
Reaction equation
[CH3:32][CH2:33][N:34]([CH2:35][CH3:36])[CH2:37][CH3:38].[CH3:39][S:40][CH2:41][C:42]#[CH:43].[Cu:49][I:50].[F:1][c:2]1[cH:3][cH:4][c:5]([C:8](=[CH:9][CH2:10][O:11][c:12]2[cH:13][c:14]([CH3:24])[c:15]([O:16][CH2:17][C:18](=[O:19])[O:20][CH3:21])[cH:22][cH:23]2)[c:25]2[cH:26][cH:27][c:28]([I:31])[cH:29][cH:30]2)[cH:6][cH:7]1.[O:44]1[CH2:45][CH2:46][CH2:47][CH2:48]1.[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>>[F:1][c:2]1[cH:3][cH:4][c:5]([C:8](=[CH:9][CH2:10][O:11][c:12]2[cH:13][c:14]([CH3:24])[c:15]([O:16][CH2:17][C:18](=[O:19])[O:20][CH3:21])[cH:22][cH:23]2)[c:25]2[cH:26][cH:27][c:28]([C:43]#[C:42][CH2:41][S:40][CH3:39])[cH:29][cH:30]2)[cH:6][cH:7]1Participants
7
Reactant 6
HCID 8028Tetrahydrofuran
HCID 8471Triethylamine
HCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)
HCID 5254243-(Methylsulfanyl)prop-1-yne
HCID 90986677Methyl 2-[4-[3-(4-fluorophenyl)-3-(4-iodophenyl)prop-2-enoxy]-2-methylphenoxy]acetate
HCID 178420554HCID 178420554, compoundProduct 1
Sources & evidence
- ORD record
- ord-2563edf2b83f4f5087e700f48464ea62
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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