HRID944624

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID223

Ammonia ion (NH4+)

H4N+

HCID312

Chloride

Cl-

HCID8028

Tetrahydrofuran

C4H8O

HCID8030

Thiophene

C4H4S

结构：CCOC(=O)c1ccc(N=Nc2ccc3c(c2)C(OS(=O)(=O)C(F)(F)F)=CCC3(C)C)cc1

HCID22323756

未命名化合物

HCID178418306

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：CCOC(=O)c1ccc(N=Nc2ccc3c(c2)C(c2cccs2)=CCC3(C)C)cc1

HCID13006282

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-74321162c8164088a430fdcd6c35ebef
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

[C:6]([Li:7])([CH3:8])([CH3:9])[CH3:10].[CH2:44]1[O:45][CH2:46][CH2:47][CH2:48]1.[CH3:11][C:12]1([CH3:43])[c:13]2[cH:14][cH:15][c:16]([N:30]=[N:31][c:32]3[cH:33][cH:34][c:35]([C:36](=[O:37])[O:38][CH2:39][CH3:40])[cH:41][cH:42]3)[cH:17][c:18]2[C:19]([O:22][S:23]([C:24]([F:25])([F:26])[F:27])(=[O:28])=[O:29])=[CH:20][CH2:21]1.[Cl-:49].[NH4+:50].[cH:1]1[cH:2][cH:3][s:4][cH:5]1.[cH:51]1[cH:52][cH:53][c:54]([P:55]([Pd:56]([P:57]([c:58]2[cH:59][cH:60][cH:61][cH:62][cH:63]2)([c:64]2[cH:65][cH:66][cH:67][cH:68][cH:69]2)[c:70]2[cH:71][cH:72][cH:73][cH:74][cH:75]2)([P:76]([c:77]2[cH:78][cH:79][cH:80][cH:81][cH:82]2)([c:83]2[cH:84][cH:85][cH:86][cH:87][cH:88]2)[c:89]2[cH:90][cH:91][cH:92][cH:93][cH:94]2)[P:95]([c:96]2[cH:97][cH:98][cH:99][cH:100][cH:101]2)([c:102]2[cH:103][cH:104][cH:105][cH:106][cH:107]2)[c:108]2[cH:109][cH:110][cH:111][cH:112][cH:113]2)([c:114]2[cH:115][cH:116][cH:117][cH:118][cH:119]2)[c:120]2[cH:121][cH:122][cH:123][cH:124][cH:125]2)[cH:126][cH:127]1>>[cH:1]1[cH:2][c:3]([C:19]2=[CH:20][CH2:21][C:12]([CH3:11])([CH3:43])[c:13]3[cH:14][cH:15][c:16]([N:30]=[N:31][c:32]4[cH:33][cH:34][c:35]([C:36](=[O:37])[O:38][CH2:39][CH3:40])[cH:41][cH:42]4)[cH:17][c:18]32)[s:4][cH:5]1