Acetate → HCID 57460382, compound

HRID 1228558Notes

Reaction equation

HRID 1228558 reaction equation
[C:61]([O-:62])(=[O:63])[CH3:64].[C:66]([O-:67])(=[O:68])[CH3:69].[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].[CH3:55][CH2:56][O:57][C:58](=[O:59])[CH3:60].[Cl:70][CH2:71][Cl:72].[Cu+2:65].[F:1][c:2]1[cH:3][c:4](-[c:20]2[c:21]([C:26]#[N:27])[cH:22][cH:23][cH:24][cH:25]2)[cH:5][cH:6][c:7]1[CH2:8][c:9]1[c:10]([CH2:17][CH2:18][CH3:19])[n:11][c:12]([CH3:16])[nH:13][c:14]1=[O:15].[cH:42]1[cH:43][cH:44][n:45][cH:46][cH:47]1>>[F:1][c:2]1[cH:3][c:4](-[c:20]2[c:21]([C:26]#[N:27])[cH:22][cH:23][cH:24][cH:25]2)[cH:5][cH:6][c:7]1[CH2:8][c:9]1[c:10]([CH2:17][CH2:18][CH3:19])[n:11][c:12]([CH3:16])[n:13](-[c:35]2[cH:34][c:32]3[c:31]([cH:37][cH:36]2)[O:30][C:29]([CH3:28])([CH3:41])[CH2:33]3)[c:14]1=[O:15]

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 1360269433'-Fluoro-4'-[(2-methyl-6-oxo-4-propyl-1,6-dihydropyrimidin-5-yl)methyl]biphenyl-2-carbonitrile

Product 1

HCID 57460382HCID 57460382, compound

Sources & evidence

ORD record
ord-32d58733051f4cee8b68140e165075e3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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