HRID954136

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

2 次

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID19660

Carbonate

CO3-2

HCID23438653

5-Bromo-2-(2-methyl-2H-tetrazol-5-yl)pyridine

C7H6BrN5

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

结构：CC1(C)OB(c2ccc(N3CC(Cn4cc(Cl)nn4)OC3=O)cc2F)OC1(C)C

HCID178431078

未命名化合物

PRODUCTS

生成物

结构：Cn1nnc(-c2ccc(-c3ccc(N4CC(Cn5cc(Cl)nn5)OC4=O)cc3F)cn2)n1

HCID178481988

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-87cbab4ae9a445eba97c815463b21329
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[Br:30][c:31]1[cH:32][cH:33][c:34](-[c:37]2[n:38][n:39][n:40]([CH3:42])[n:41]2)[n:35][cH:36]1.[CH3:49][N:50]([CH3:51])[CH:52]=[O:53].[F:1][c:2]1[cH:3][c:4]([N:17]2[C:18](=[O:29])[O:19][CH:20]([CH2:22][n:23]3[n:24][n:25][c:26]([Cl:28])[cH:27]3)[CH2:21]2)[cH:5][cH:6][c:7]1[B:8]1[O:9][C:10]([CH3:11])([CH3:12])[C:13]([CH3:14])([CH3:15])[O:16]1.[Na+:43].[Na+:44].[O-:45][C:46](=[O:47])[O-:48].[cH:54]1[cH:55][cH:56][c:57]([P:58]([Pd:59]([P:60]([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)[c:73]2[cH:74][cH:75][cH:76][cH:77][cH:78]2)([P:79]([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)[c:92]2[cH:93][cH:94][cH:95][cH:96][cH:97]2)[P:98]([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)[c:123]2[cH:124][cH:125][cH:126][cH:127][cH:128]2)[cH:129][cH:130]1>>[F:1][c:2]1[cH:3][c:4]([N:17]2[C:18](=[O:29])[O:19][CH:20]([CH2:22][n:23]3[n:24][n:25][c:26]([Cl:28])[cH:27]3)[CH2:21]2)[cH:5][cH:6][c:7]1-[c:31]1[cH:32][cH:33][c:34](-[c:37]2[n:38][n:39][n:40]([CH3:42])[n:41]2)[n:35][cH:36]1