HRID1113268

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

2 次

HCID6212

Chloroform

CHCl3

HCID8028

Tetrahydrofuran

C4H8O

HCID11776

Triphenylphosphine

C18H15P

HCID19660

Carbonate

CO3-2

HCID23938

Palladium

2 次

HCID67184

1-Bromopyrrolidine-2,5-dione

C4H4BrNO2

HCID95417

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

C17H14O

3 次

HCID25247755

未命名化合物

结构：CC(C)S(=O)(=O)NC1Cc2ccc(B3OC(C)(C)C(C)(C)O3)cc2C1

HCID46899971

未命名化合物

PRODUCTS

生成物

结构：CCn1nc(C(F)(F)F)cc1Cc1ccc2c(c1)CC(NS(=O)(=O)C(C)C)C2

HCID67088141

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1559112d6cd54055bc14fe480d90fbeb
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:20][N:21]1[C:22](=[O:23])[CH2:24][CH2:25][C:26]1=[O:27].[C:71](=[O:72])([O-:73])[O-:74].[CH2:66]1[O:67][CH2:68][CH2:69][CH2:70]1.[CH3:28][C:29]1([CH3:30])[C:31]([CH3:32])([CH3:33])[O:34][B:35]([c:36]2[cH:37][c:38]3[c:42]([cH:43][cH:44]2)[CH2:41][CH:40]([NH:45][S:46](=[O:47])(=[O:48])[CH:49]([CH3:50])[CH3:51])[CH2:39]3)[O:52]1.[CH:133]([Cl:134])([Cl:135])[Cl:136].[Cl:53][CH2:54][c:55]1[cH:56][c:57]([C:62]([F:63])([F:64])[F:65])[n:58][n:59]1[CH2:60][CH3:61].[Na+:75].[Na+:76].[O:115]=[C:116]([CH:117]=[CH:118][c:119]1[cH:120][cH:121][cH:122][cH:123][cH:124]1)[CH:125]=[CH:126][c:127]1[cH:128][cH:129][cH:130][cH:131][cH:132]1.[O:79]=[C:80]([CH:81]=[CH:82][c:83]1[cH:84][cH:85][cH:86][cH:87][cH:88]1)[CH:89]=[CH:90][c:91]1[cH:92][cH:93][cH:94][cH:95][cH:96]1.[O:97]=[C:98]([CH:99]=[CH:100][c:101]1[cH:102][cH:103][cH:104][cH:105][cH:106]1)[CH:107]=[CH:108][c:109]1[cH:110][cH:111][cH:112][cH:113][cH:114]1.[Pd:77].[Pd:78].[c:1]1([P:2]([c:3]2[cH:4][cH:5][cH:6][cH:7][cH:8]2)[c:9]2[cH:10][cH:11][cH:12][cH:13][cH:14]2)[cH:15][cH:16][cH:17][cH:18][cH:19]1>>[c:36]1([CH2:54][c:55]2[cH:56][c:57]([C:62]([F:63])([F:64])[F:65])[n:58][n:59]2[CH2:60][CH3:61])[cH:37][c:38]2[c:42]([cH:43][cH:44]1)[CH2:41][CH:40]([NH:45][S:46](=[O:47])(=[O:48])[CH:49]([CH3:50])[CH3:51])[CH2:39]2