Acetate → 4-(6-Cyano-pyridin-3-yloxy)-2,2-dimethyl-2,3-dihydro-benzofuran-6-carboxylic acid (1-methyl-1H-pyrazol-3-yl)-amide

HRID 308084Notes

Reaction equation

HRID 308084 reaction equation
[C:49]([O-:50])(=[O:51])[CH3:52].[C:54]([O-:55])(=[O:56])[CH3:57].[CH3:18][n:19]1[n:20][c:21]([NH:24][C:25](=[O:26])[c:27]2[cH:28][c:29]3[c:30]([c:36]([OH:38])[cH:37]2)[CH2:31][C:32]([CH3:34])([CH3:35])[O:33]3)[cH:22][cH:23]1.[CH3:1][C:2]1([CH3:3])[C:4]([CH3:5])([CH3:6])[O:7][B:8]([c:9]2[cH:10][cH:11][c:12]([C:15]#[N:16])[n:13][cH:14]2)[O:17]1.[CH3:39][CH2:40][N:41]([CH2:42][CH3:43])[CH2:44][CH3:45].[Cl:46][CH2:47][Cl:48].[Cu+2:53]>>[c:9]1([O:38][c:36]2[c:30]3[c:29]([cH:28][c:27]([C:25]([NH:24][c:21]4[n:20][n:19]([CH3:18])[cH:23][cH:22]4)=[O:26])[cH:37]2)[O:33][C:32]([CH3:34])([CH3:35])[CH2:31]3)[cH:10][cH:11][c:12]([C:15]#[N:16])[n:13][cH:14]1

Participants

7

Reactant 6

HCID 175Acetate2×HCID 6344DichloromethaneHCID 8471TriethylamineHCID 27099Cupric cationHCID 164141882-Cyanopyridine-5-boronic acid pinacol esterHCID 595600842,3-Dihydro-4-hydroxy-2,2-dimethyl-N-(1-methyl-1H-pyrazol-3-yl)-6-benzofurancarboxamide

Product 1

HCID 667561004-(6-Cyano-pyridin-3-yloxy)-2,2-dimethyl-2,3-dihydro-benzofuran-6-carboxylic acid (1-methyl-1H-pyrazol-3-yl)-amide

Sources & evidence

ORD record
ord-ea5ea5fb1ee64652a0c95c1ca76efde7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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