HRID831936

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID30165

Iodide ion

I-

HCID81531

Diisopropylethylamine

C8H19N

HCID167070

2-Chloro-1-methylpyridinium

C6H7ClN+

HCID5193990

N,N'-Di-Boc-thiourea

C11H20N2O4S

HCID18667638

未命名化合物

PRODUCTS

生成物

结构：COc1ccnc(-c2ccc(C)c(N=C(NC(=O)OC(C)(C)C)NC(=O)OC(C)(C)C)c2)c1

HCID135710951

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-22f79d500fee4601962215330c60f32d
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:17]([CH3:18])([CH3:19])([CH3:20])[O:21][C:22](=[O:23])[NH:24][C:25](=[S:26])[NH:27][C:28](=[O:29])[O:30][C:31]([CH3:32])([CH3:33])[CH3:34].[CH3:1][O:2][c:3]1[cH:4][c:5](-[c:9]2[cH:10][cH:11][c:12]([CH3:16])[c:13]([NH2:14])[cH:15]2)[n:6][cH:7][cH:8]1.[CH3:45][n+:46]1[cH:47][cH:48][cH:49][cH:50][c:51]1[Cl:52].[CH:35]([N:36]([CH:37]([CH3:38])[CH3:39])[CH2:40][CH3:41])([CH3:42])[CH3:43].[Cl:53][CH2:54][Cl:55].[I-:44]>>[CH3:1][O:2][c:3]1[cH:4][c:5](-[c:9]2[cH:10][cH:11][c:12]([CH3:16])[c:13]([N:14]=[C:25]([NH:24][C:22]([O:21][C:17]([CH3:18])([CH3:19])[CH3:20])=[O:23])[NH:27][C:28](=[O:29])[O:30][C:31]([CH3:32])([CH3:33])[CH3:34])[cH:15]2)[n:6][cH:7][cH:8]1