HRID2122593

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID8058

n-Hexane

C6H14

HCID8857

Ethyl acetate

C4H8O2

HCID16028

Tetrabutylammonium

C16H36N+

HCID28179

Fluoride

F-

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

PRODUCTS

生成物

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

HCID22281922

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5171f0a255284cfcb1319b668e476284
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][cH:7][c:8]([S:11](=[O:12])(=[O:13])[NH:14][c:15]2[c:16](-[c:41]3[cH:42][cH:43][c:44]([CH3:47])[cH:45][cH:46]3)[c:17]([O:30][CH2:31][CH2:32][O:33][c:34]3[n:35][cH:36][c:37]([Cl:40])[cH:38][n:39]3)[n:18][n:19]2[CH2:20][CH2:21][O:22][Si:23]([C:24]([CH3:25])([CH3:26])[CH3:27])([CH3:28])[CH3:29])[cH:9][cH:10]1.[CH2:78]1[O:79][CH2:80][CH2:81][CH2:82]1.[CH3:49][CH2:50][CH2:51][CH2:52][N+:53]([CH2:54][CH2:55][CH2:56][CH3:57])([CH2:58][CH2:59][CH2:60][CH3:61])[CH2:62][CH2:63][CH2:64][CH3:65].[CH3:66][CH2:67][O:68][C:69](=[O:70])[CH3:71].[CH3:72][CH2:73][CH2:74][CH2:75][CH2:76][CH3:77].[F-:48]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][cH:7][c:8]([S:11](=[O:12])(=[O:13])[NH:14][c:15]2[c:16](-[c:41]3[cH:42][cH:43][c:44]([CH3:47])[cH:45][cH:46]3)[c:17]([O:30][CH2:31][CH2:32][O:33][c:34]3[n:35][cH:36][c:37]([Cl:40])[cH:38][n:39]3)[n:18][n:19]2[CH2:20][CH2:21][OH:22])[cH:9][cH:10]1