HRID1565387

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID24350

Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)

CuI

HCID26369855

Ethyl 2-chloro-1,3-oxazole-5-carboxylate

C6H6ClNO3

结构：[CH3][Sn]([CH3])([CH3])[c]1cc(Cl)cc2c1cnn2S(=O)(=O)c1ccccc1

HCID59564703

6-Chloro-1-(phenylsulfonyl)-4-(trimethylstannyl)-1H-indazole

C16H17ClN2O2SSn

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)c1cnc(-c2cc(Cl)cc3c2cnn3S(=O)(=O)c2ccccc2)o1

HCID59564714

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-695f64f2a3a3489fb2f35f7f88687e93
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

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