HRID1133230

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID8083

Morpholine

C4H9NO

结构：C=CCOC(=O)C1=C(C)N(c2cccc(C(F)(F)F)c2)C(=O)NC1c1ccc(C#N)cc1S(C)(=O)=O

HCID42642358

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：CC1=C(C(=O)O)C(c2ccc(C#N)cc2S(C)(=O)=O)NC(=O)N1c1cccc(C(F)(F)F)c1

HCID66601847

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d116ddcf4409429fb233990cf1c3f232
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

[C:1](#[N:2])[c:3]1[cH:4][c:5]([S:33](=[O:34])(=[O:35])[CH3:36])[c:6]([CH:9]2[NH:10][C:11](=[O:32])[N:12]([c:22]3[cH:23][c:24]([C:28]([F:29])([F:30])[F:31])[cH:25][cH:26][cH:27]3)[C:13]([CH3:21])=[C:14]2[C:15](=[O:16])[O:17][CH2:18][CH:19]=[CH2:20])[cH:7][cH:8]1.[CH2:37]1[NH:38][CH2:39][CH2:40][O:41][CH2:42]1.[CH2:43]1[O:44][CH2:45][CH2:46][CH2:47]1.[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:1](#[N:2])[c:3]1[cH:4][c:5]([S:33](=[O:34])(=[O:35])[CH3:36])[c:6]([CH:9]2[NH:10][C:11](=[O:32])[N:12]([c:22]3[cH:23][c:24]([C:28]([F:29])([F:30])[F:31])[cH:25][cH:26][cH:27]3)[C:13]([CH3:21])=[C:14]2[C:15](=[O:16])[OH:17])[cH:7][cH:8]1