HRID207557

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID23938

Palladium

2 次

HCID31275

1,4-Dioxane

C4H8O2

HCID95417

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

C17H14O

3 次

结构：CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21

HCID636044

1,1'-(9,9-Dimethyl-9H-xanthene-4,5-diyl)bis(1,1-diphenylphosphine)

C39H32OP2

HCID1019318

未命名化合物

HCID4574913

未命名化合物

HCID43381453

1,3-Di-tert-butyl-1H-pyrazol-5-amine

C11H21N3

PRODUCTS

生成物

结构：CC(C)(C)c1cc(Nc2ccc(S(=O)(=O)Nc3nccs3)cc2)n(C(C)(C)C)n1

HCID57551215

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7aa800d37880463ea5930c984da1fa35
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[C:59]([CH3:60])([CH3:61])([CH3:62])[n:63]1[n:64][c:65]([C:69]([CH3:70])([CH3:71])[CH3:72])[cH:66][c:67]1[NH2:68].[CH2:79]1[O:80][CH2:81][CH2:82][O:83][CH2:84]1.[CH3:17][C:18]1([CH3:19])[c:20]2[cH:21][cH:22][cH:23][c:24]([P:25]([c:26]3[cH:27][cH:28][cH:29][cH:30][cH:31]3)[c:32]3[cH:33][cH:34][cH:35][cH:36][cH:37]3)[c:38]2[O:39][c:40]2[c:41]1[cH:42][cH:43][cH:44][c:45]2[P:46]([c:47]1[cH:48][cH:49][cH:50][cH:51][cH:52]1)[c:53]1[cH:54][cH:55][cH:56][cH:57][cH:58]1.[CH3:73][C:74]([CH3:75])([O-:76])[CH3:77].[I:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[NH:11][c:12]2[s:13][cH:14][cH:15][n:16]2)[cH:6][cH:7]1.[Na+:78].[O:105]=[C:106]([CH:107]=[CH:108][c:109]1[cH:110][cH:111][cH:112][cH:113][cH:114]1)[CH:115]=[CH:116][c:117]1[cH:118][cH:119][cH:120][cH:121][cH:122]1.[O:123]=[C:124]([CH:125]=[CH:126][c:127]1[cH:128][cH:129][cH:130][cH:131][cH:132]1)[CH:133]=[CH:134][c:135]1[cH:136][cH:137][cH:138][cH:139][cH:140]1.[O:87]=[C:88]([CH:89]=[CH:90][c:91]1[cH:92][cH:93][cH:94][cH:95][cH:96]1)[CH:97]=[CH:98][c:99]1[cH:100][cH:101][cH:102][cH:103][cH:104]1.[Pd:85].[Pd:86]>>[c:2]1([NH:68][c:67]2[n:63]([C:59]([CH3:60])([CH3:61])[CH3:62])[n:64][c:65]([C:69]([CH3:70])([CH3:71])[CH3:72])[cH:66]2)[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[NH:11][c:12]2[s:13][cH:14][cH:15][n:16]2)[cH:6][cH:7]1