HRID1207813

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8028

Tetrahydrofuran

C4H8O

HCID8058

n-Hexane

C6H14

HCID8857

Ethyl acetate

C4H8O2

HCID72879

Methanesulfonamide

CH5NO2S

HCID81531

Diisopropylethylamine

C8H19N

HCID111923

Propylphosphonic anhydride

C9H21O6P3

HCID521170

2,4,5-Trifluorobenzoic acid

C7H3F3O2

PRODUCTS

生成物

HCID58042435

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ed4a36fe166142719004da825bfde2cb
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

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