HRID141954

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID311

Citric acid

C6H8O7

HCID923

Sodium ion

Na+

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8028

Tetrahydrofuran

C4H8O

HCID166653

Hydride

H-

HCID2727725

5-chloro-2-(methylsulfonyl)pyrimidine

C5H5ClN2O2S

结构：Cc1ccc(-c2c(OCCO)nn(CCO[Si](C)(C)C(C)(C)C)c2NS(=O)(=O)c2ccc(C(C)(C)C)cc2)cc1

HCID23400314

未命名化合物

PRODUCTS

生成物

结构：Cc1ccc(-c2c(OCCOc3ncc(Cl)cn3)nn(CCO[Si](C)(C)C(C)(C)C)c2NS(=O)(=O)c2ccc(C(C)(C)C)cc2)cc1

HCID23400322

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f51a04edfdeb48aea884e348968870c6
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

[C:3]([CH3:4])([CH3:5])([CH3:6])[c:7]1[cH:8][cH:9][c:10]([S:13](=[O:14])(=[O:15])[NH:16][c:17]2[c:18](-[c:36]3[cH:37][cH:38][c:39]([CH3:42])[cH:40][cH:41]3)[c:19]([O:32][CH2:33][CH2:34][OH:35])[n:20][n:21]2[CH2:22][CH2:23][O:24][Si:25]([CH3:26])([CH3:27])[C:28]([CH3:29])([CH3:30])[CH3:31])[cH:11][cH:12]1.[CH2:67]1[O:68][CH2:69][CH2:70][CH2:71]1.[Cl:43][c:44]1[cH:45][n:46][c:47]([S:50]([CH3:51])(=[O:52])=[O:53])[n:48][cH:49]1.[H-:1].[Na+:2].[O:72]=[CH:73][N:74]([CH3:75])[CH3:76].[OH:54][C:55]([CH2:56][C:57]([C:58](=[O:59])[OH:60])([CH2:61][C:62](=[O:63])[OH:64])[OH:65])=[O:66]>>[C:3]([CH3:4])([CH3:5])([CH3:6])[c:7]1[cH:8][cH:9][c:10]([S:13](=[O:14])(=[O:15])[NH:16][c:17]2[c:18](-[c:36]3[cH:37][cH:38][c:39]([CH3:42])[cH:40][cH:41]3)[c:19]([O:32][CH2:33][CH2:34][O:35][c:47]3[n:46][cH:45][c:44]([Cl:43])[cH:49][n:48]3)[n:20][n:21]2[CH2:22][CH2:23][O:24][Si:25]([CH3:26])([CH3:27])[C:28]([CH3:29])([CH3:30])[CH3:31])[cH:11][cH:12]1