HRID834942

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID3283

Diethyl Ether

C4H10O

HCID6344

Dichloromethane

CH2Cl2

HCID8058

n-Hexane

C6H14

HCID21052

Benzophenone, 4-amino-3-methyl-

C14H13NO

HCID24386

Thionyl chloride

Cl2OS

HCID31374

Dimethylacetamide

C4H9NO

HCID2775125

3,3,3-Trifluoro-2-hydroxy-2-methylpropanoic acid

C4H5F3O3

PRODUCTS

生成物

结构：Cc1cc(C(=O)c2ccccc2)ccc1NC(=O)C(C)(O)C(F)(F)F

HCID9819831

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-bd22765f5c6e4d8a942b44fa408b0cc8
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

[CH2:47]([O:48][CH2:49][CH3:50])[CH3:51].[CH3:32][N:33]([CH3:34])[C:35](=[O:36])[CH3:37].[CH3:38][CH2:39][CH2:40][CH2:41][CH2:42][CH3:43].[Cl:44][CH2:45][Cl:46].[F:1][C:2]([C:3]([C:4](=[O:5])[OH:6])([CH3:7])[OH:8])([F:9])[F:10].[NH2:15][c:16]1[c:17]([CH3:30])[cH:18][c:19]([C:20](=[O:21])[c:22]2[cH:23][cH:24][cH:25][cH:26][cH:27]2)[cH:28][cH:29]1.[OH2:31].[S:11]([Cl:12])([Cl:13])=[O:14]>>[F:1][C:2]([C:3]([C:4](=[O:5])[NH:15][c:16]1[c:17]([CH3:30])[cH:18][c:19]([C:20](=[O:21])[c:22]2[cH:23][cH:24][cH:25][cH:26][cH:27]2)[cH:28][cH:29]1)([CH3:7])[OH:8])([F:9])[F:10]