HRID1136103

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6344

Dichloromethane

CH2Cl2

HCID8028

Tetrahydrofuran

C4H8O

HCID16028

Tetrabutylammonium

C16H36N+

HCID28179

Fluoride

F-

结构：CC(C)(C)OC(=O)COc1cccc(CN(Cc2ccc(C(C)(C)CO[Si](C)(C)C(C)(C)C)cc2)S(=O)(=O)c2cccnc2)c1

HCID69729909

(3-{[{4-[2-(tert-Butyl-dimethyl-silanyloxy)-1,1-dimethyl-ethyl]-benzyl}-(pyridine-3-sulfonyl)-amino]-methyl}-phenoxy)-acetic acid tert-butyl ester

C35H50N2O6SSi

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)COc1cccc(CN(Cc2ccc(C(C)(C)CO)cc2)S(=O)(=O)c2cccnc2)c1

HCID69731661

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ee578dc9b58947b292b9efbe52751e2e
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH2:7][O:8][c:9]1[cH:10][c:11]([CH2:15][N:16]([S:17](=[O:18])(=[O:19])[c:20]2[cH:21][n:22][cH:23][cH:24][cH:25]2)[CH2:26][c:27]2[cH:28][cH:29][c:30]([C:33]([CH2:34][O:35][Si:36]([C:37]([CH3:38])([CH3:39])[CH3:40])([CH3:41])[CH3:42])([CH3:43])[CH3:44])[cH:31][cH:32]2)[cH:12][cH:13][cH:14]1)=[O:45].[CH2:68]1[O:69][CH2:70][CH2:71][CH2:72]1.[CH3:47][CH2:48][CH2:49][CH2:50][N+:51]([CH2:52][CH2:53][CH2:54][CH3:55])([CH2:56][CH2:57][CH2:58][CH3:59])[CH2:60][CH2:61][CH2:62][CH3:63].[Cl:65][CH2:66][Cl:67].[F-:46].[OH2:64]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH2:7][O:8][c:9]1[cH:10][c:11]([CH2:15][N:16]([S:17](=[O:18])(=[O:19])[c:20]2[cH:21][n:22][cH:23][cH:24][cH:25]2)[CH2:26][c:27]2[cH:28][cH:29][c:30]([C:33]([CH2:34][OH:35])([CH3:43])[CH3:44])[cH:31][cH:32]2)[cH:12][cH:13][cH:14]1)=[O:45]