HRID102481

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8471

Triethylamine

C6H15N

HCID8857

Ethyl acetate

C4H8O2

HCID11776

Triphenylphosphine

C18H15P

2 次

HCID24290

未命名化合物

HCID24350

Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)

CuI

HCID593690

5-Bromo-2-iodopyridine

C5H3BrIN

HCID25254788

未命名化合物

PRODUCTS

生成物

结构：COC(=O)C1CN(Cc2ccc(C#Cc3ccc(Br)cn3)c(F)c2)C1

HCID57625189

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-edc8c4f13eb54bddbd6849cd524db151
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[Br:1][c:2]1[cH:3][cH:4][c:5]([I:8])[n:6][cH:7]1.[C:9](#[CH:10])[c:11]1[c:12]([F:26])[cH:13][c:14]([CH2:15][N:16]2[CH2:17][CH:18]([C:20](=[O:21])[O:22][CH3:23])[CH2:19]2)[cH:24][cH:25]1.[CH3:27][CH2:28][N:29]([CH2:30][CH3:31])[CH2:32][CH3:33].[CH3:34][CH2:35][O:36][C:37]([CH3:38])=[O:39].[Cu:40][I:41].[Pd:42]([Cl:43])[Cl:44].[c:45]1([P:46]([c:47]2[cH:48][cH:49][cH:50][cH:51][cH:52]2)[c:53]2[cH:54][cH:55][cH:56][cH:57][cH:58]2)[cH:59][cH:60][cH:61][cH:62][cH:63]1.[c:64]1([P:65]([c:66]2[cH:67][cH:68][cH:69][cH:70][cH:71]2)[c:72]2[cH:73][cH:74][cH:75][cH:76][cH:77]2)[cH:78][cH:79][cH:80][cH:81][cH:82]1>>[Br:1][c:2]1[cH:3][cH:4][c:5]([C:10]#[C:9][c:11]2[c:12]([F:26])[cH:13][c:14]([CH2:15][N:16]3[CH2:17][CH:18]([C:20](=[O:21])[O:22][CH3:23])[CH2:19]3)[cH:24][cH:25]2)[n:6][cH:7]1