HRID170356

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID8028

Tetrahydrofuran

C4H8O

HCID65578

Ethanedioyl dichloride

C2Cl2O2

HCID79617

4-Mesylaniline

C7H9NO2S

HCID81531

Diisopropylethylamine

C8H19N

HCID67252161

未命名化合物

PRODUCTS

生成物

结构：Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(C)c1-c1ccccc1C(F)(F)F

HCID25052024

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-38144ce9dccf44e2810bc6fce710f122
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

[CH2:50]1[O:51][CH2:52][CH2:53][CH2:54]1.[CH3:1][n:2]1[cH:3][c:4]([C:18](=[O:19])[OH:20])[c:5]([CH3:17])[c:6]1-[c:7]1[c:8]([C:13]([F:14])([F:15])[F:16])[cH:9][cH:10][cH:11][cH:12]1.[CH3:27][S:28](=[O:29])(=[O:30])[c:31]1[cH:32][cH:33][c:34]([NH2:35])[cH:36][cH:37]1.[CH:38]([N:39]([CH2:40][CH3:41])[CH:42]([CH3:43])[CH3:44])([CH3:45])[CH3:46].[Cl:21][C:22]([C:23]([Cl:24])=[O:25])=[O:26].[Cl:47][CH2:48][Cl:49]>>[CH3:1][n:2]1[cH:3][c:4]([C:18](=[O:20])[NH:35][c:34]2[cH:33][cH:32][c:31]([S:28]([CH3:27])(=[O:29])=[O:30])[cH:37][cH:36]2)[c:5]([CH3:17])[c:6]1-[c:7]1[c:8]([C:13]([F:14])([F:15])[F:16])[cH:9][cH:10][cH:11][cH:12]1