HRID99416

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

2 次

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID11776

Triphenylphosphine

C18H15P

2 次

HCID19660

Carbonate

CO3-2

HCID24290

未命名化合物

HCID24350

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

CuI

HCID639438

2-Bromo-6-fluoropyridine

C5H3BrFN

HCID86613493

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)Nc1c(-c2ccc(C#Cc3cccc(F)n3)s2)nc2cnccn12

HCID11552894

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d53785b6e0bd4769af323d188913f069
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:22][c:23]1[n:24][c:25]([F:29])[cH:26][cH:27][cH:28]1.[C:1]([CH3:2])([CH3:3])([CH3:4])[NH:5][c:6]1[c:7](-[c:15]2[s:16][c:17]([C:20]#[CH:21])[cH:18][cH:19]2)[n:8][c:9]2[n:10]1[cH:11][cH:12][n:13][cH:14]2.[C:30](=[O:31])([O-:32])[O-:33].[Cu:41][I:42].[Na+:34].[Na+:35].[O:36]=[CH:37][N:38]([CH3:39])[CH3:40].[Pd:43]([Cl:44])[Cl:45].[c:46]1([P:47]([c:48]2[cH:49][cH:50][cH:51][cH:52][cH:53]2)[c:54]2[cH:55][cH:56][cH:57][cH:58][cH:59]2)[cH:60][cH:61][cH:62][cH:63][cH:64]1.[c:65]1([P:66]([c:67]2[cH:68][cH:69][cH:70][cH:71][cH:72]2)[c:73]2[cH:74][cH:75][cH:76][cH:77][cH:78]2)[cH:79][cH:80][cH:81][cH:82][cH:83]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[NH:5][c:6]1[c:7](-[c:15]2[s:16][c:17]([C:20]#[C:21][c:23]3[n:24][c:25]([F:29])[cH:26][cH:27][cH:28]3)[cH:18][cH:19]2)[n:8][c:9]2[n:10]1[cH:11][cH:12][n:13][cH:14]2