HRID1207813

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

Dimethylformamide

C3H7NO

HCID8028

Tetrahydrofuran

C4H8O

HCID8058

Hexane

C6H14

HCID8857

Ethyl Acetate

C4H8O2

HCID72879

Methanesulfonamide

CH5NO2S

HCID81531

Diisopropylethylamine

C8H19N

HCID111923

Propylphosphonic anhydride

C9H21O6P3

HCID521170

2,4,5-Trifluorobenzoic acid

C7H3F3O2

PRODUCTS

产物

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