HRID88493

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1140

Toluene

C7H8

HCID11661

Tetramethyltin

C4H12Sn

HCID31404

Butylated hydroxytoluene

C15H24O

结构：CC(C)(C)OC(=O)N1CCC(Nc2cccc3cncc(Br)c23)CC1

HCID21979972

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：Cc1cncc2cccc(NC3CCN(C(=O)OC(C)(C)C)CC3)c12

HCID21979807

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8e116a60873244e39c7a8775d9bd7187
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[cH:3][n:4][cH:5][c:6]2[cH:7][cH:8][cH:9][c:10]([NH:12][CH:13]3[CH2:14][CH2:15][N:16]([C:19](=[O:20])[O:21][C:22]([CH3:23])([CH3:24])[CH3:25])[CH2:17][CH2:18]3)[c:11]12.[CH3:26][Sn:27]([CH3:28])([CH3:29])[CH3:30].[CH3:31][c:32]1[cH:33][c:34]([C:35]([CH3:36])([CH3:37])[CH3:38])[c:39]([OH:40])[c:41]([C:42]([CH3:43])([CH3:44])[CH3:45])[cH:46]1.[CH3:47][c:48]1[cH:49][cH:50][cH:51][cH:52][cH:53]1.[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>>[c:2]1([CH3:26])[cH:3][n:4][cH:5][c:6]2[cH:7][cH:8][cH:9][c:10]([NH:12][CH:13]3[CH2:14][CH2:15][N:16]([C:19](=[O:20])[O:21][C:22]([CH3:23])([CH3:24])[CH3:25])[CH2:17][CH2:18]3)[c:11]12