HRID213763

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID90027

2,2,2-Trifluoroethyl trichloromethanesulphonate

C3H2Cl3F3O3S

HCID166653

Hydride

H-

HCID22293222

未命名化合物

结构：CC(C)(C)OC(=O)NC1CN(C(=O)OCc2ccccc2)CCNC1=O

HCID22293224

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)NC1CN(C(=O)OCc2ccccc2)CCN(CC(F)(F)F)C1=O

HCID22293256

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ccf7183652a3459fa87f05f80e232fef
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

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