Triphenylphosphine → [5-(3-Amino-3-methyl-but-1-ynyl)-2-chloro-phenyl]-[6-(2,4-difluoro-phenylamino)-pyridin-3-yl]-methanone

HRID 663794Notes

Reaction equation

HRID 663794 reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5]([Cl:25])[c:6]([C:8](=[O:9])[c:10]2[cH:11][n:12][c:13]([NH:16][c:17]3[c:18]([F:24])[cH:19][c:20]([F:23])[cH:21][cH:22]3)[cH:14][cH:15]2)[cH:7]1.[Cu:32][I:33].[NH2:26][C:27]([C:28]#[CH:29])([CH3:30])[CH3:31].[Pd:34]([Cl:35])[Cl:36].[c:37]1([P:38]([c:39]2[cH:40][cH:41][cH:42][cH:43][cH:44]2)[c:45]2[cH:46][cH:47][cH:48][cH:49][cH:50]2)[cH:51][cH:52][cH:53][cH:54][cH:55]1.[c:56]1([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)[cH:70][cH:71][cH:72][cH:73][cH:74]1>>[c:2]1([C:29]#[C:28][C:27]([NH2:26])([CH3:30])[CH3:31])[cH:3][cH:4][c:5]([Cl:25])[c:6]([C:8](=[O:9])[c:10]2[cH:11][n:12][c:13]([NH:16][c:17]3[c:18]([F:24])[cH:19][c:20]([F:23])[cH:21][cH:22]3)[cH:14][cH:15]2)[cH:7]1

Participants

6

Reactant 5

HCID 11776Triphenylphosphine2×HCID 24290Palladium ChlorideHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 763193-Butyn-2-amine, 2-methyl-HCID 22349591(5-Bromo-2-chloro-phenyl)-[6-(2,4-difluoro-phenylamino)-pyridin-3-yl]-methanone

Product 1

HCID 10296020[5-(3-Amino-3-methyl-but-1-ynyl)-2-chloro-phenyl]-[6-(2,4-difluoro-phenylamino)-pyridin-3-yl]-methanone

Sources & evidence

ORD record
ord-82a7370ea7e44ca398e1a72cc3e1b818
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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