HRID1144999

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID1140

Toluene

C7H8

HCID23938

Palladium

2 次

HCID95417

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

C17H14O

3 次

HCID2762835

4-Bromo-2-methylpyridine

C6H6BrN

结构：Cc1cc(C)cc(P(c2cc(C)cc(C)c2)c2ccc3ccccc3c2-c2c(P(c3cc(C)cc(C)c3)c3cc(C)cc(C)c3)ccc3ccccc23)c1

HCID4189905

1,1′-[(1R)-[1,1′-Binaphthalene]-2,2′-diyl]bis[1,1-bis(3,5-dimethylphenyl)phosphine

C52H48P2

HCID4574913

未命名化合物

HCID59199102

8-(3-Methoxyphenyl)[1,2,4]triazolo[1,5-a]pyridin-2-amine

C13H12N4O

PRODUCTS

生成物

结构：COc1cccc(-c2cccn3nc(Nc4ccnc(C)c4)nc23)c1

HCID44554317

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-987bf97dedd647ecb21c579b73391b68
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

[Br:19][c:20]1[cH:21][c:22]([CH3:26])[n:23][cH:24][cH:25]1.[CH3:1][O:2][c:3]1[cH:4][c:5](-[c:9]2[c:10]3[n:11]([cH:12][cH:13][cH:14]2)[n:15][c:16]([NH2:18])[n:17]3)[cH:6][cH:7][cH:8]1.[CH3:27][C:28]([CH3:29])([O-:30])[CH3:31].[CH3:87][c:88]1[cH:89][cH:90][cH:91][cH:92][cH:93]1.[Na+:32].[O:114]=[C:115]([CH:116]=[CH:117][c:118]1[cH:119][cH:120][cH:121][cH:122][cH:123]1)[CH:124]=[CH:125][c:126]1[cH:127][cH:128][cH:129][cH:130][cH:131]1.[O:132]=[C:133]([CH:134]=[CH:135][c:136]1[cH:137][cH:138][cH:139][cH:140][cH:141]1)[CH:142]=[CH:143][c:144]1[cH:145][cH:146][cH:147][cH:148][cH:149]1.[O:96]=[C:97]([CH:98]=[CH:99][c:100]1[cH:101][cH:102][cH:103][cH:104][cH:105]1)[CH:106]=[CH:107][c:108]1[cH:109][cH:110][cH:111][cH:112][cH:113]1.[Pd:94].[Pd:95].[c:33]1([P:34]([c:35]2[cH:36][c:37]([CH3:38])[cH:39][c:40]([CH3:41])[cH:42]2)[c:43]2[cH:44][cH:45][c:46]3[c:47]([cH:48][cH:49][cH:50][cH:51]3)[c:52]2-[c:53]2[c:54]3[c:55]([cH:56][cH:57][cH:58][cH:59]3)[cH:60][cH:61][c:62]2[P:63]([c:64]2[cH:65][c:66]([CH3:67])[cH:68][c:69]([CH3:70])[cH:71]2)[c:72]2[cH:73][c:74]([CH3:75])[cH:76][c:77]([CH3:78])[cH:79]2)[cH:80][c:81]([CH3:82])[cH:83][c:84]([CH3:85])[cH:86]1>>[CH3:1][O:2][c:3]1[cH:4][c:5](-[c:9]2[c:10]3[n:11]([cH:12][cH:13][cH:14]2)[n:15][c:16]([NH:18][c:20]2[cH:21][c:22]([CH3:26])[n:23][cH:24][cH:25]2)[n:17]3)[cH:6][cH:7][cH:8]1