HRID125583

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

HCID8028

Tetrahydrofuran

C4H8O

HCID23938

Palladium

2 次

HCID28179

Fluoride

F-

HCID77531

2,4-Dichloropyrimidine

C4H2Cl2N2

HCID95417

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

C17H14O

3 次

HCID68680596

未命名化合物

PRODUCTS

产物

HCID86611607

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-8d2f0f7ce1624999970a08445a6e0404
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

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