HRID835644

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID23938

Palladium

2 次

HCID28486

Lithium ion

Li+

HCID95417

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

C17H14O

3 次

HCID3280088

未命名化合物

HCID16108974

4-(2-Chloropyridin-3-yl)pyrimidine

C9H6ClN3

结构：Cc1ccc2c(Nc3cccc(C(F)(F)F)c3)nccc2c1N

HCID44478903

未命名化合物

PRODUCTS

生成物

结构：Cc1ccc2c(Nc3cccc(C(F)(F)F)c3)nccc2c1Nc1ncccc1-c1ccncn1

HCID16214904

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a492997ba13b4bce86fa23ea17d9ba43
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[CH2:103]1[O:104][CH2:105][CH2:106][CH2:107]1.[CH3:1][c:2]1[c:3]([NH2:23])[c:4]2[cH:5][cH:6][n:7][c:8]([NH:12][c:13]3[cH:14][c:15]([C:19]([F:20])([F:21])[F:22])[cH:16][cH:17][cH:18]3)[c:9]2[cH:10][cH:11]1.[CH3:37][Si:38]([N-:39][Si:40]([CH3:41])([CH3:42])[CH3:43])([CH3:44])[CH3:45].[Cl:24][c:25]1[n:26][cH:27][cH:28][cH:29][c:30]1-[c:31]1[n:32][cH:33][n:34][cH:35][cH:36]1.[Li+:46].[O:49]=[C:50]([CH:51]=[CH:52][c:53]1[cH:54][cH:55][cH:56][cH:57][cH:58]1)[CH:59]=[CH:60][c:61]1[cH:62][cH:63][cH:64][cH:65][cH:66]1.[O:67]=[C:68]([CH:69]=[CH:70][c:71]1[cH:72][cH:73][cH:74][cH:75][cH:76]1)[CH:77]=[CH:78][c:79]1[cH:80][cH:81][cH:82][cH:83][cH:84]1.[O:85]=[C:86]([CH:87]=[CH:88][c:89]1[cH:90][cH:91][cH:92][cH:93][cH:94]1)[CH:95]=[CH:96][c:97]1[cH:98][cH:99][cH:100][cH:101][cH:102]1.[Pd:47].[Pd:48]>>[CH3:1][c:2]1[c:3]([NH:23][c:25]2[n:26][cH:27][cH:28][cH:29][c:30]2-[c:31]2[n:32][cH:33][n:34][cH:35][cH:36]2)[c:4]2[cH:5][cH:6][n:7][c:8]([NH:12][c:13]3[cH:14][c:15]([C:19]([F:20])([F:21])[F:22])[cH:16][cH:17][cH:18]3)[c:9]2[cH:10][cH:11]1