Acetate → 4'-{[1-(2,2-Dimethyl-2,3-dihydro-1-benzofuran-5-yl)-2-methyl-6-oxo-4-propyl-1,6-dihydropyrimidin-5-yl]methyl}-2'-fluorobiphenyl-2-carbonitrile

HRID 2125108Notizen

Reaktionsgleichung

Reaktionsgleichung von HRID 2125108
[C:55]([O-:56])(=[O:57])[CH3:58].[C:60]([O-:61])(=[O:62])[CH3:63].[CH2:70]([Cl:71])[Cl:72].[CH3:28][C:29]1([CH3:41])[O:30][c:31]2[c:32]([cH:34][c:35]([B:38]([OH:39])[OH:40])[cH:36][cH:37]2)[CH2:33]1.[CH3:48][CH2:49][N:50]([CH2:51][CH3:52])[CH2:53][CH3:54].[CH3:64][CH2:65][O:66][C:67](=[O:68])[CH3:69].[Cu+2:59].[F:1][c:2]1[c:3](-[c:20]2[c:21]([C:26]#[N:27])[cH:22][cH:23][cH:24][cH:25]2)[cH:4][cH:5][c:6]([CH2:8][c:9]2[c:10]([CH2:17][CH2:18][CH3:19])[n:11][c:12]([CH3:16])[nH:13][c:14]2=[O:15])[cH:7]1.[cH:42]1[cH:43][cH:44][n:45][cH:46][cH:47]1>>[F:1][c:2]1[c:3](-[c:20]2[c:21]([C:26]#[N:27])[cH:22][cH:23][cH:24][cH:25]2)[cH:4][cH:5][c:6]([CH2:8][c:9]2[c:10]([CH2:17][CH2:18][CH3:19])[n:11][c:12]([CH3:16])[n:13](-[c:35]3[cH:34][c:32]4[c:31]([cH:37][cH:36]3)[O:30][C:29]([CH3:28])([CH3:41])[CH2:33]4)[c:14]2=[O:15])[cH:7]1

Komponenten

9

Edukt 8

HCID 175Acetate2×HCID 1049PyridineHCID 6344DichloromethaneHCID 8471TriethylamineHCID 8857Ethyl AcetateHCID 27099Cupric cationHCID 23005350(2,2-Dimethyl-2,3-dihydro-1-benzofuran-5-yl)boronic acidHCID 1362033812'-Fluoro-4'-[(2-methyl-6-oxo-4-propyl-1,6-dihydropyrimidin-5-yl)methyl]biphenyl-2-carbonitrile

Produkt 1

HCID 574609034'-{[1-(2,2-Dimethyl-2,3-dihydro-1-benzofuran-5-yl)-2-methyl-6-oxo-4-propyl-1,6-dihydropyrimidin-5-yl]methyl}-2'-fluorobiphenyl-2-carbonitrile

Quellen und Nachweise

ORD-Eintrag
ord-7913a29478e54c64bb8817a1e7aaff7e
Quelldatensatz
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

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