HRID2318657

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID11776

Triphenylphosphine

C18H15P

2 次

HCID16028

Tetrabutylammonium

C16H36N+

HCID24290

未命名化合物

HCID24350

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

CuI

HCID28179

Fluoride

F-

HCID57606936

4-Bromo-1-methyl-1H-pyrazolo[3,4-c]pyridine

C7H6BrN3

结构：C[Si](C)(C)C#Cc1cccc(NC(=O)c2ccccc2)c1

HCID67399535

未命名化合物

PRODUCTS

生成物

结构：Cn1ncc2c(C#Cc3cccc(NC(=O)c4ccccc4)c3)cncc21

HCID59536452

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-fc203a8d7f534bc19bd99cd19231fac6
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

[Br:1][c:2]1[c:3]2[c:4]([cH:5][n:6][cH:7]1)[n:8]([CH3:11])[n:9][cH:10]2.[CH2:34]([N+:35]([CH2:36][CH2:37][CH2:38][CH3:39])([CH2:40][CH2:41][CH2:42][CH3:43])[CH2:44][CH2:45][CH2:46][CH3:47])[CH2:48][CH2:49][CH3:50].[CH2:51]1[O:52][CH2:53][CH2:54][CH2:55]1.[CH3:12][Si:13]([CH3:14])([CH3:15])[C:16]#[C:17][c:18]1[cH:19][c:20]([NH:24][C:25]([c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)=[O:32])[cH:21][cH:22][cH:23]1.[Cu:97][I:98].[F-:33].[Pd:56]([Cl:57])[Cl:58].[c:59]1([P:60]([c:61]2[cH:62][cH:63][cH:64][cH:65][cH:66]2)[c:67]2[cH:68][cH:69][cH:70][cH:71][cH:72]2)[cH:73][cH:74][cH:75][cH:76][cH:77]1.[c:78]1([P:79]([c:80]2[cH:81][cH:82][cH:83][cH:84][cH:85]2)[c:86]2[cH:87][cH:88][cH:89][cH:90][cH:91]2)[cH:92][cH:93][cH:94][cH:95][cH:96]1>>[c:2]1([C:16]#[C:17][c:18]2[cH:19][c:20]([NH:24][C:25]([c:26]3[cH:27][cH:28][cH:29][cH:30][cH:31]3)=[O:32])[cH:21][cH:22][cH:23]2)[c:3]2[c:4]([cH:5][n:6][cH:7]1)[n:8]([CH3:11])[n:9][cH:10]2