HRID2135740

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+

反应SMILES：CC(C)(C)OC(=O)NC(=S)NC(=O)OC(C)(C)C

HCID5193990

N,N'-Di-Boc-thiourea

C11H20N2O4S

HCID18667622

未命名化合物

PRODUCTS

产物

反应SMILES：COc1ccnc(-c2ccc(F)c(N=C(NC(=O)OC(C)(C)C)NC(=O)OC(C)(C)C)c2)c1

HCID135706154

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-a9e10642936642aa888f7608ff464ac3
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

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].[CH3:45][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].[F:1][c:2]1[c:3]([NH2:4])[cH:5][c:6](-[c:9]2[n:10][cH:11][cH:12][c:13]([O:15][CH3:16])[cH:14]2)[cH:7][cH:8]1.[I-:44]>>[F:1][c:2]1[c:3]([N:4]=[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:5][c:6](-[c:9]2[n:10][cH:11][cH:12][c:13]([O:15][CH3:16])[cH:14]2)[cH:7][cH:8]1