HRID2313582

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID947

Nitrogen

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

HCID11776

Triphenylphosphine

C18H15P

HCID19660

Carbonate

CO3-2

HCID23938

Palladium

2 次

HCID95417

1,5-Diphenyl-1,4-pentadien-3-one

C17H14O

3 次

HCID104967

Cesium(1+)

Cs+

2 次

HCID21817667

2,6-Dimethylimidazo[1,2-b]pyridazine

C8H9N3

HCID66721149

未命名化合物

PRODUCTS

生成物

结构：Cc1cccc(-c2cc(C)c(-c3c(C)nc4ccc(C)nn34)s2)n1

HCID68841674

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-319bed1aca9f4c83a913c2380842e7c5
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:12][c:13]1[c:14]([CH3:25])[cH:15][c:16](-[c:18]2[n:19][c:20]([CH3:24])[cH:21][cH:22][cH:23]2)[s:17]1.[C:26](=[O:27])([O-:28])[O-:29].[CH3:1][c:2]1[n:3][c:4]2[n:5]([n:6][c:7]([CH3:10])[cH:8][cH:9]2)[cH:11]1.[Cl:53][CH2:54][Cl:55].[Cs+:30].[Cs+:31].[N:32]#[N:33].[O:112]=[CH:113][N:114]([CH3:115])[CH3:116].[O:58]=[C:59]([CH:60]=[CH:61][c:62]1[cH:63][cH:64][cH:65][cH:66][cH:67]1)[CH:68]=[CH:69][c:70]1[cH:71][cH:72][cH:73][cH:74][cH:75]1.[O:76]=[C:77]([CH:78]=[CH:79][c:80]1[cH:81][cH:82][cH:83][cH:84][cH:85]1)[CH:86]=[CH:87][c:88]1[cH:89][cH:90][cH:91][cH:92][cH:93]1.[O:94]=[C:95]([CH:96]=[CH:97][c:98]1[cH:99][cH:100][cH:101][cH:102][cH:103]1)[CH:104]=[CH:105][c:106]1[cH:107][cH:108][cH:109][cH:110][cH:111]1.[Pd:56].[Pd:57].[c:34]1([P:35]([c:36]2[cH:37][cH:38][cH:39][cH:40][cH:41]2)[c:42]2[cH:43][cH:44][cH:45][cH:46][cH:47]2)[cH:48][cH:49][cH:50][cH:51][cH:52]1>>[CH3:1][c:2]1[n:3][c:4]2[n:5]([n:6][c:7]([CH3:10])[cH:8][cH:9]2)[c:11]1-[c:13]1[c:14]([CH3:25])[cH:15][c:16](-[c:18]2[n:19][c:20]([CH3:24])[cH:21][cH:22][cH:23]2)[s:17]1