HRID1551345

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

结构：[CH3][Sn]([CH3])([CH3])[c]1cc(N)c2cnn(S(=O)(=O)c3ccccc3)c2c1

HCID58255743

未命名化合物

HCID59519513

N-(5-Bromo-2-chloro-3-pyridinyl)methanesulfonamide

C6H6BrClN2O2S

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：CS(=O)(=O)Nc1cc(-c2cc(N)c3cnn(S(=O)(=O)c4ccccc4)c3c2)cnc1Cl

HCID58255829

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-2acc047d91a64cd1b701d8a2b0552e28
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

[Br:29][c:30]1[cH:31][c:32]([NH:37][S:38](=[O:39])(=[O:40])[CH3:41])[c:33]([Cl:36])[n:34][cH:35]1.[Cl:42][CH2:43][Cl:44].[O:24]=[CH:25][N:26]([CH3:27])[CH3:28].[c:1]1([S:7](=[O:8])(=[O:9])[n:10]2[n:11][cH:12][c:13]3[c:14]([NH2:23])[cH:15][c:16]([Sn:19]([CH3:20])([CH3:21])[CH3:22])[cH:17][c:18]23)[cH:2][cH:3][cH:4][cH:5][cH:6]1.[cH:45]1[cH:46][cH:47][c:48]([P:49]([Pd:50]([P:51]([c:52]2[cH:53][cH:54][cH:55][cH:56][cH:57]2)([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)([P:70]([c:71]2[cH:72][cH:73][cH:74][cH:75][cH:76]2)([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)[P:89]([c:90]2[cH:91][cH:92][cH:93][cH:94][cH:95]2)([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)[cH:120][cH:121]1>>[c:1]1([S:7](=[O:8])(=[O:9])[n:10]2[n:11][cH:12][c:13]3[c:14]([NH2:23])[cH:15][c:16](-[c:30]4[cH:31][c:32]([NH:37][S:38](=[O:39])(=[O:40])[CH3:41])[c:33]([Cl:36])[n:34][cH:35]4)[cH:17][c:18]23)[cH:2][cH:3][cH:4][cH:5][cH:6]1