HRID148583

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID8471

Triethylamine

C6H15N

HCID11776

Triphenylphosphine

C18H15P

HCID24350

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

CuI

HCID1516511

2-Chloro-4-iodopyridine

C5H3ClIN

HCID86602964

未命名化合物

PRODUCTS

生成物

结构：Cc1nc(C#Cc2ccnc(Cl)c2)c(C)n1-c1ccc(F)cc1F

HCID11688761

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-379d48f9853b48cea38a2bf8c5a3094f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

[CH2:45]1[O:46][CH2:47][CH2:48][CH2:49]1.[CH2:50]([N:51]([CH2:52][CH3:53])[CH2:54][CH3:55])[CH3:56].[Cl:1][c:2]1[n:3][cH:4][cH:5][c:6]([I:8])[cH:7]1.[Cu:57][I:58].[F:28][c:29]1[c:30](-[n:36]2[c:37]([CH3:44])[n:38][c:39]([C:42]#[CH:43])[c:40]2[CH3:41])[cH:31][cH:32][c:33]([F:35])[cH:34]1.[c:9]1([P:10]([c:11]2[cH:12][cH:13][cH:14][cH:15][cH:16]2)[c:17]2[cH:18][cH:19][cH:20][cH:21][cH:22]2)[cH:23][cH:24][cH:25][cH:26][cH:27]1>>[Cl:1][c:2]1[n:3][cH:4][cH:5][c:6]([C:43]#[C:42][c:39]2[n:38][c:37]([CH3:44])[n:36](-[c:30]3[c:29]([F:28])[cH:34][c:33]([F:35])[cH:32][cH:31]3)[c:40]2[CH3:41])[cH:7]1