HRID2335785

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

HCID166653

Hydride

H-

HCID58957911

未命名化合物

HCID58957915

4-Ethoxy-1,3-dihydro-2H-1,5-benzodiazepin-2-one

C11H12N2O2

PRODUCTS

生成物

结构：CCOC1=Nc2ccccc2N(CC(=O)N(c2ccc(OC)nc2)C(C)C)C(=O)C1

HCID58957909

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-19f9580d31104b10b8d0b3d02c76df56
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

[Br:18][CH2:19][C:20](=[O:21])[N:22]([c:23]1[cH:24][n:25][c:26]([O:29][CH3:30])[cH:27][cH:28]1)[CH:31]([CH3:32])[CH3:33].[CH2:1]([CH3:2])[O:3][C:4]1=[N:5][c:6]2[c:7]([cH:12][cH:13][cH:14][cH:15]2)[NH:8][C:9](=[O:11])[CH2:10]1.[Cl:40][CH2:41][Cl:42].[H-:17].[Na+:16].[O:34]=[CH:35][N:36]([CH3:37])[CH3:38].[OH2:39]>>[CH2:1]([CH3:2])[O:3][C:4]1=[N:5][c:6]2[c:7]([cH:12][cH:13][cH:14][cH:15]2)[N:8]([CH2:19][C:20](=[O:21])[N:22]([c:23]2[cH:24][n:25][c:26]([O:29][CH3:30])[cH:27][cH:28]2)[CH:31]([CH3:32])[CH3:33])[C:9](=[O:11])[CH2:10]1