HRID102302

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8071

未命名化合物

HCID8857

Ethyl acetate

C4H8O2

HCID123161

Stannane

H4Sn

HCID2783171

2-Bromo-5-fluoropyridine

C5H3BrFN

结构：C=C(Cc1ccc(Br)cc1)c1nc(CC(C)(C)C)cn1S(=O)(=O)N(C)C

HCID66705618

未命名化合物

结构：c1ccc([PH](c2ccccc2)(c2ccccc2)[Pd]([PH](c2ccccc2)(c2ccccc2)c2ccccc2)([PH](c2ccccc2)(c2ccccc2)c2ccccc2)[PH](c2ccccc2)(c2ccccc2)c2ccccc2)cc1

HCID178420554

未命名化合物

PRODUCTS

生成物

结构：C=C(Cc1ccc(-c2ccc(F)cn2)cc1)c1nc(CC(C)(C)C)cn1S(=O)(=O)N(C)C

HCID66705844

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-de24ed517a0c4878958467afa0d85b80
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

[Br:1][c:2]1[n:3][cH:4][c:5]([F:8])[cH:6][cH:7]1.[Br:9][c:10]1[cH:11][cH:12][c:13]([CH2:14][C:15](=[CH2:16])[c:17]2[n:18]([S:27](=[O:28])(=[O:29])[N:30]([CH3:31])[CH3:32])[cH:19][c:20]([CH2:22][C:23]([CH3:24])([CH3:25])[CH3:26])[n:21]2)[cH:33][cH:34]1.[CH3:36][O:37][CH2:38][CH2:39][O:40][CH3:41].[CH3:42][CH2:43][O:44][C:45](=[O:46])[CH3:47].[SnH4:35].[cH:48]1[cH:49][cH:50][c:51]([P:52]([Pd:53]([P:54]([c:55]2[cH:56][cH:57][cH:58][cH:59][cH:60]2)([c:61]2[cH:62][cH:63][cH:64][cH:65][cH:66]2)[c:67]2[cH:68][cH:69][cH:70][cH:71][cH:72]2)([P:73]([c:74]2[cH:75][cH:76][cH:77][cH:78][cH:79]2)([c:80]2[cH:81][cH:82][cH:83][cH:84][cH:85]2)[c:86]2[cH:87][cH:88][cH:89][cH:90][cH:91]2)[P:92]([c:93]2[cH:94][cH:95][cH:96][cH:97][cH:98]2)([c:99]2[cH:100][cH:101][cH:102][cH:103][cH:104]2)[c:105]2[cH:106][cH:107][cH:108][cH:109][cH:110]2)([c:111]2[cH:112][cH:113][cH:114][cH:115][cH:116]2)[c:117]2[cH:118][cH:119][cH:120][cH:121][cH:122]2)[cH:123][cH:124]1>>[c:2]1(-[c:10]2[cH:11][cH:12][c:13]([CH2:14][C:15](=[CH2:16])[c:17]3[n:18]([S:27](=[O:28])(=[O:29])[N:30]([CH3:31])[CH3:32])[cH:19][c:20]([CH2:22][C:23]([CH3:24])([CH3:25])[CH3:26])[n:21]3)[cH:33][cH:34]2)[n:3][cH:4][c:5]([F:8])[cH:6][cH:7]1