HRID167084

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID947

Nitrogen

HCID4943

Propofol

C12H18O

HCID8028

Tetrahydrofuran

C4H8O

HCID8471

Triethylamine

C6H15N

HCID10758631

未命名化合物

PRODUCTS

生成物

结构：CCCCCCCCCCCCOC(=O)NS(=O)(=O)Oc1c(C(C)C)cccc1C(C)C

HCID10648021

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d52b8148b5df4184ae1757972f79a099
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

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