HRID1229831

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8471

Triethylamine

C6H15N

HCID8857

Ethyl acetate

C4H8O2

HCID97743

N-Carbobenzoyl-DL-valine

C13H17NO4

HCID54531055

Ethyl cyano{[(methanesulfonyl)oxy]imino}acetate

C6H8N2O5S

PRODUCTS

生成物

结构：CCOC(=O)C(C#N)=NOC(=O)C(NC(=O)OCc1ccccc1)C(C)C

HCID178472146

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-17aa79a719da41e6a44a94394f46c98f
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

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