HRID808160

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID4343651

11-chlorocarbonyl-undecanoic acid ethyl ester

C14H25ClO3

结构：CSc1sc(C(=N)NC(=O)OC(C)(C)C)cc1S(=O)(=O)c1cccc(-c2c(C)cccc2N)c1

HCID145857623

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)CCCCCCCCCCC(=O)Nc1cccc(C)c1-c1cccc(S(=O)(=O)c2cc(C(=N)NC(=O)OC(C)(C)C)sc2SC)c1

HCID140482501

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6b78cbdef9b94cd1a5a4fd7b4ebd6bef
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[C:19]([CH3:20])([CH3:21])([CH3:22])[O:23][C:24]([NH:25][C:26](=[NH:27])[c:28]1[s:29][c:30]([S:50][CH3:51])[c:31]([S:33](=[O:34])(=[O:35])[c:36]2[cH:37][c:38](-[c:42]3[c:43]([NH2:49])[cH:44][cH:45][cH:46][c:47]3[CH3:48])[cH:39][cH:40][cH:41]2)[cH:32]1)=[O:52].[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][C:15](=[O:16])[Cl:17])=[O:18].[CH3:53][CH2:54][N:55]([CH2:56][CH3:57])[CH2:58][CH3:59].[Cl:60][CH2:61][Cl:62]>>[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][C:15](=[O:16])[NH:49][c:43]1[c:42](-[c:38]2[cH:37][c:36]([S:33]([c:31]3[c:30]([S:50][CH3:51])[s:29][c:28]([C:26]([NH:25][C:24]([O:23][C:19]([CH3:20])([CH3:21])[CH3:22])=[O:52])=[NH:27])[cH:32]3)(=[O:34])=[O:35])[cH:41][cH:40][cH:39]2)[c:47]([CH3:48])[cH:46][cH:45][cH:44]1)=[O:18]