HRID31915

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID78308

Pyridine, 2-chloro-5-nitro-

C5H3ClN2O2

HCID98654

Benzonitrile, 4-(bromoacetyl)-

C9H6BrNO

结构：O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].[Ce+4].[NH4+].[NH4+]

HCID180504

未命名化合物

结构：Nc1nc(NCCNc2ccc(-c3ncc[nH]3)c(-c3ccc(Cl)cc3Cl)n2)ccc1[N+](=O)[O-]

HCID22142808

未命名化合物

PRODUCTS

生成物

结构：N#Cc1ccc(-c2nc(NCCNc3ccc([N+](=O)[O-])cn3)ccc2-c2ncc[nH]2)cc1

HCID22142958

未命名化合物

AUXILIARIES

试剂、催化剂与溶剂

溶剂HCID176

Acetic Acid

C2H4O2

溶剂HCID962

Water

H2O

PROCEDURE

实验过程

4-[3-imidazolyl-6-({2-[(5-nitro(2-pyridyl))amino]ethyl}amino)-2-pyridyl]Benzenecarbonitrile was prepared from 4-cyanophenacyl bromide, CAN for the oxidation (1:1 acetic acid and water with heating at 80° C. for 1 hour), and 2-chloro-5-nitropyridine using the general method for {2-[(6-amino-5-nitro(2-pyridyl))amino]ethyl}[6-(2,4-dichlorophenyl)-5-imidazolyl(2-pyridyl)]amine.

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1edb383ab3cc4fde8e34fdcb39c74736
来源数据集: uspto-grants-2008_09
DOI: 10.6084/m9.figshare.5104873.v1
专利: US07425557B2
来源说明: uspto-grants-2008_09

反应 SMILES

[C:1]([C:3]1[CH:12]=[CH:11][C:6]([C:7](=O)[CH2:8]Br)=[CH:5][CH:4]=1)#[N:2].[O:13]=[N+:14]([O-:16])[O-].[O-][N+](=O)[O-].[O-][N+](=O)[O-].[O-][N+](=O)[O-].[O-][N+](=O)[O-].[O-][N+](=O)[O-].[Ce+4].[NH4+].[NH4+].Cl[C:41]1C=C[C:44]([N+:47]([O-])=O)=[CH:43][N:42]=1.N[C:51]1[N:56]=[C:55]([NH:57][CH2:58][CH2:59][NH:60][C:61]2[CH:66]=[CH:65]C(C3NC=CN=3)=C(C3C=CC(Cl)=CC=3Cl)[N:62]=2)[CH:54]=[CH:53][C:52]=1[N+]([O-])=O>O.C(O)(=O)C>[NH:42]1[CH:43]=[CH:44][N:47]=[C:41]1[C:8]1[C:7]([C:6]2[CH:11]=[CH:12][C:3]([C:1]#[N:2])=[CH:4][CH:5]=2)=[N:62][C:61]([NH:60][CH2:59][CH2:58][NH:57][C:55]2[CH:54]=[CH:53][C:52]([N+:14]([O-:16])=[O:13])=[CH:51][N:56]=2)=[CH:66][CH:65]=1