HRID664562

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID81531

Diisopropylethylamine

C8H19N

HCID94429

Triphosgene

C3Cl6O3

HCID43650694

未命名化合物

HCID57863323

Methyl 2-isopropylhydrazinecarboxylate

C5H12N2O2

PRODUCTS

生成物

结构：COC(=O)NN(C(=O)N1CCCC1c1ncc(-c2ccc(Br)cc2)[nH]1)C(C)C

HCID66621058

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b35d93f197614ab9998b359c1600c52f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

[Br:31][c:32]1[cH:33][cH:34][c:35](-[c:38]2[cH:39][n:40][c:41]([CH:43]3[NH:44][CH2:45][CH2:46][CH2:47]3)[nH:42]2)[cH:36][cH:37]1.[CH3:13][O:14][C:15](=[O:16])[NH:17][NH:18][CH:19]([CH3:20])[CH3:21].[CH:22]([N:23]([CH2:24][CH3:25])[CH:26]([CH3:27])[CH3:28])([CH3:29])[CH3:30].[Cl:1][C:2]([Cl:3])([O:4][C:5]([O:6][C:7]([Cl:8])([Cl:9])[Cl:10])=[O:11])[Cl:12].[Cl:48][CH2:49][Cl:50]>>[C:5](=[O:11])([N:18]([NH:17][C:15]([O:14][CH3:13])=[O:16])[CH:19]([CH3:20])[CH3:21])[N:44]1[CH:43]([c:41]2[n:40][cH:39][c:38](-[c:35]3[cH:34][cH:33][c:32]([Br:31])[cH:37][cH:36]3)[nH:42]2)[CH2:47][CH2:46][CH2:45]1