HRID816373

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID312

Chloride

Cl-

HCID8857

Ethyl acetate

C4H8O2

HCID24386

Thionyl chloride

Cl2OS

结构：O=C(O)c1ccc(S(=O)(=O)Nc2ccc(F)c(C(F)(F)F)c2)cc1

HCID3699990

未命名化合物

HCID11971028

2-Amino-1-(2,2-dimethyl-1,3-dioxolan-4-yl)ethan-1-ol

C7H15NO3

PRODUCTS

生成物

结构：CC1(C)OCC(C(O)CNC(=O)c2ccc(S(=O)(=O)Nc3ccc(F)c(C(F)(F)F)c3)cc2)O1

HCID67899351

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-515005887be743689fc2fb8a0c3c2c13
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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