HRID1216806

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID769

Bicarbonate Ion

CHO3-

HCID923

Sodium ion

Na+

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID12682606

tert-Butylsulfamyl chloride

C4H10ClNO2S

HCID53707869

未命名化合物

PRODUCTS

生成物

结构：CCN1CCCC1CNC(=O)c1cc(NS(=O)(=O)NC(C)(C)C)c(C)cc1OC

HCID12848767

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-acd6465fd351480a828215b2e57b21d6
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

[C:22]([CH3:23])([CH3:24])([CH3:25])[NH:26][S:27](=[O:28])(=[O:29])[Cl:30].[CH2:1]([CH3:2])[N:3]1[CH:4]([CH2:8][NH:9][C:10]([c:11]2[c:12]([O:19][CH3:20])[cH:13][c:14]([CH3:18])[c:15]([NH2:17])[cH:16]2)=[O:21])[CH2:5][CH2:6][CH2:7]1.[CH2:36]([Cl:37])[Cl:38].[CH3:39][CH2:40][N:41]([CH2:42][CH3:43])[CH2:44][CH3:45].[Na+:31].[OH:32][C:33](=[O:34])[O-:35]>>[CH2:1]([CH3:2])[N:3]1[CH:4]([CH2:8][NH:9][C:10]([c:11]2[c:12]([O:19][CH3:20])[cH:13][c:14]([CH3:18])[c:15]([NH:17][S:27]([NH:26][C:22]([CH3:23])([CH3:24])[CH3:25])(=[O:28])=[O:29])[cH:16]2)=[O:21])[CH2:5][CH2:6][CH2:7]1