HRID136202

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID679

Dimethyl sulfoxide

C2H6OS

HCID813

Potassium cation

K+

HCID961

Hydroxide

HO-

HCID6344

Dichloromethane

CH2Cl2

HCID8857

Ethyl acetate

C4H8O2

HCID2774553

3-Fluoro-4-methoxybenzyl bromide

C8H8BrFO

HCID18526053

4-Methoxy-1H-indazol-3-amine

C8H9N3O

结构：CC(=O)c1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CN(C(=O)[O-])C(C)(C)C)c1

HCID86644815

未命名化合物

PRODUCTS

生成物

HCID58054511

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-42b16c8574b64ff288fd1cfe48024725
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

[Br:53][CH2:54][c:55]1[cH:56][c:57]([F:63])[c:58]([O:61][CH3:62])[cH:59][cH:60]1.[CH3:13][C:14]([N:15]([CH2:16][c:17]1[cH:18][cH:19][cH:20][c:21]([CH2:22][n:23]2[c:24]3[c:25]([c:26]([C:27](=[O:28])[CH3:29])[cH:30][cH:31][cH:32]3)[c:33]([NH:34][S:35]([c:36]3[s:37][c:38]([Cl:39])[cH:40][cH:41]3)(=[O:42])=[O:43])[n:44]2)[cH:45]1)[C:46](=[O:47])[O-:48])([CH3:49])[CH3:50].[CH3:1][O:2][c:3]1[c:4]2[c:5]([NH2:12])[n:6][nH:7][c:8]2[cH:9][cH:10][cH:11]1.[CH3:64][S:65]([CH3:66])=[O:67].[CH3:68][CH2:69][O:70][C:71]([CH3:72])=[O:73].[Cl:74][CH2:75][Cl:76].[K+:52].[OH-:51]>>[CH3:1][O:2][c:3]1[c:4]2[c:5]([NH2:12])[n:6][n:7]([CH2:54][c:55]3[cH:56][c:57]([F:63])[c:58]([O:61][CH3:62])[cH:59][cH:60]3)[c:8]2[cH:9][cH:10][cH:11]1