HRID912951

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：Fc1cc(-c2cc(C(F)(F)F)cc3[nH]c(Cl)nc23)cc(F)c1F

HCID11638867

未命名化合物

HCID67400479

未命名化合物

PRODUCTS

生成物

结构：CNC(=O)C1CN(c2ncc(CO)cc2Cl)CCN1c1nc2cc(C(F)(F)F)cc(-c3cc(F)c(F)c(F)c3)c2[nH]1

HCID178485547

未命名化合物

AUXILIARIES

试剂、催化剂与溶剂

溶剂HCID702

Ethanol

C2H6O

PROCEDURE

实验过程

A mixture of 4-(3-chloro-5-hydroxymethyl-pyridin-2-yl)-piperazine-2-carboxylic acid methylamide from step (d) above (114 mg, 0.4 mmol) and 2-chloro-6-trifluoromethyl-4-(3,4,5-trifluoro-phenyl)-1H-benzoimidazole (140 mg, 0.4 mmol, Example 51b) in EtOH (1 mL) reacted under the conditions of Example 3c to give the title compound as a white solid. MS ESI, pos. ion) m/e: 599 (M+1).

WORKUP

后处理

customreacted under the conditions of Example 3c

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ab6ede9e424347f6be8b6d1900e17fe3
来源数据集: uspto-grants-2011_09
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08026241B2
来源说明: uspto-grants-2011_09

反应 SMILES

[CH3:1][NH:2][C:3]([CH:5]1[CH2:10][N:9]([C:11]2[C:16]([Cl:17])=[CH:15][C:14]([CH2:18][OH:19])=[CH:13][N:12]=2)[CH2:8][CH2:7][NH:6]1)=[O:4].Cl[C:21]1[NH:25][C:24]2[CH:26]=[C:27]([C:39]([F:42])([F:41])[F:40])[CH:28]=[C:29]([C:30]3[CH:35]=[C:34]([F:36])[C:33]([F:37])=[C:32]([F:38])[CH:31]=3)[C:23]=2[N:22]=1>CCO>[CH3:1][NH:2][C:3]([CH:5]1[CH2:10][N:9]([C:11]2[C:16]([Cl:17])=[CH:15][C:14]([CH2:18][OH:19])=[CH:13][N:12]=2)[CH2:8][CH2:7][N:6]1[C:21]1[NH:22][C:23]2[C:29]([C:30]3[CH:31]=[C:32]([F:38])[C:33]([F:37])=[C:34]([F:36])[CH:35]=3)=[CH:28][C:27]([C:39]([F:42])([F:40])[F:41])=[CH:26][C:24]=2[N:25]=1)=[O:4]