Acetate → HCID 59351604, compound

HRID 2145512Notes

Reaction equation

HRID 2145512 reaction equation
[C:66]([O-:67])(=[O:68])[CH3:69].[C:71]([O-:72])(=[O:73])[CH3:74].[CH2:1]([CH3:2])[c:3]1[cH:4][c:5]2[c:6]([n:7]([CH2:13][c:14]3[c:15]([F:28])[cH:16][c:17](-[c:20]4[c:21]([C:26]#[N:27])[cH:22][cH:23][cH:24][cH:25]4)[cH:18][cH:19]3)[c:8](=[O:12])[nH:9][c:10]2=[O:11])[s:29]1.[CH3:30][C:31]1([CH3:43])[O:32][c:33]2[c:34]([cH:36][c:37]([B:40]([OH:41])[OH:42])[cH:38][cH:39]2)[CH2:35]1.[CH3:44][CH2:45][N:46]([CH2:47][CH3:48])[CH2:49][CH3:50].[CH3:60][CH2:61][O:62][C:63](=[O:64])[CH3:65].[Cl:57][CH2:58][Cl:59].[Cu+2:70].[cH:51]1[cH:52][cH:53][n:54][cH:55][cH:56]1>>[CH2:1]([CH3:2])[c:3]1[cH:4][c:5]2[c:6]([n:7]([CH2:13][c:14]3[c:15]([F:28])[cH:16][c:17](-[c:20]4[c:21]([C:26]#[N:27])[cH:22][cH:23][cH:24][cH:25]4)[cH:18][cH:19]3)[c:8](=[O:12])[n:9](-[c:37]3[cH:36][c:34]4[c:33]([cH:39][cH:38]3)[O:32][C:31]([CH3:30])([CH3:43])[CH2:35]4)[c:10]2=[O:11])[s:29]1

Participants

9

Reactant 8

HCID 175Acetate2×HCID 1049PyridineHCID 6344DichloromethaneHCID 8471TriethylamineHCID 8857Ethyl AcetateHCID 27099Cupric cationHCID 23005350(2,2-Dimethyl-2,3-dihydro-1-benzofuran-5-yl)boronic acidHCID 593515684'-[(6-ethyl-2,4-dioxo-3,4-dihydrothieno[2,3-d]pyrimidin-1(2H)-yl)methyl]-3'-fluorobiphenyl-2-carbonitrile

Product 1

HCID 59351604HCID 59351604, compound

Sources & evidence

ORD record
ord-0eb6df6289ec4be0b2ae6f1e561a09f4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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