HRID298012

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID769

Bicarbonate Ion

CHO3-

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID6344

Dichloromethane

CH2Cl2

HCID7397

p-Toluenesulfonyl chloride

C7H7ClO2S

HCID8471

Triethylamine

C6H15N

HCID61221

Dibutylstannane oxide

C8H18OSn

HCID67134591

未命名化合物

PRODUCTS

生成物

结构：COc1ccc2ncc(F)c(C(O)COS(=O)(=O)c3ccc(C)cc3)c2n1

HCID86603362

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a3e5f5a6166649018444b0f12516c1bd
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[C:49](=[O:50])([OH:51])[O-:52].[CH2:25]([Sn:26](=[O:27])[CH2:28][CH2:29][CH2:30][CH3:31])[CH2:32][CH2:33][CH3:34].[CH3:18][CH2:19][N:20]([CH2:21][CH3:22])[CH2:23][CH3:24].[Cl:46][CH2:47][Cl:48].[F:1][c:2]1[cH:3][n:4][c:5]2[cH:6][cH:7][c:8]([O:16][CH3:17])[n:9][c:10]2[c:11]1[CH:12]([CH2:13][OH:14])[OH:15].[Na+:53].[OH2:54].[S:35](=[O:36])(=[O:37])([c:38]1[cH:39][cH:40][c:41]([CH3:42])[cH:43][cH:44]1)[Cl:45]>>[F:1][c:2]1[cH:3][n:4][c:5]2[cH:6][cH:7][c:8]([O:16][CH3:17])[n:9][c:10]2[c:11]1[CH:12]([CH2:13][O:14][S:35](=[O:36])(=[O:37])[c:38]1[cH:39][cH:40][c:41]([CH3:42])[cH:43][cH:44]1)[OH:15]