HRID1189653

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID12734

Diisopropylcarbodiimide

C7H14N2

HCID56840192

未命名化合物

结构：CNc1cc(N2CCC(C(F)(F)F)CC2)c(C(=O)OC)cc1N

HCID67957313

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)c1cc2nc(Nc3c(Cl)ccc(CNC(=O)C(C)(C)C)c3Cl)n(C)c2cc1N1CCC(C(F)(F)F)CC1

HCID67957576

未命名化合物

AUXILIARIES

试剂、催化剂与溶剂

溶剂HCID8028

Tetrahydrofuran

C4H8O

PROCEDURE

实验过程

The title compound is prepared in analogy to 6c from methyl-2-[4-trifluoromethyl-piperidinyl]-4-methylamino-5-amino-benzoate (349 mg, 1.01 mmol), and N-(2,4-dichloro-3-isothiocyanato-benzyl)-2,2-dimethyl-propionamide (336 mg, 1.06 mmol), DIC (0.19 mL, 1.2 mmol) and THF (20 mL).

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-2e7a93fc72914d6bbc6df6dbc73fb06e
来源数据集: uspto-grants-2014_03
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08674113B2
来源说明: uspto-grants-2014_03

反应 SMILES

[CH3:1][O:2][C:3](=[O:23])[C:4]1[CH:9]=[C:8]([NH2:10])[C:7]([NH:11][CH3:12])=[CH:6][C:5]=1[N:13]1[CH2:18][CH2:17][CH:16]([C:19]([F:22])([F:21])[F:20])[CH2:15][CH2:14]1.[Cl:24][C:25]1[C:38]([N:39]=[C:40]=S)=[C:37]([Cl:42])[CH:36]=[CH:35][C:26]=1[CH2:27][NH:28][C:29](=[O:34])[C:30]([CH3:33])([CH3:32])[CH3:31].[CH3:43]C(C)N=C=NC(C)C>C1COCC1>[CH2:1]([O:2][C:3]([C:4]1[C:5]([N:13]2[CH2:14][CH2:15][CH:16]([C:19]([F:21])([F:20])[F:22])[CH2:17][CH2:18]2)=[CH:6][C:7]2[N:11]([CH3:12])[C:40]([NH:39][C:38]3[C:37]([Cl:42])=[CH:36][CH:35]=[C:26]([CH2:27][NH:28][C:29](=[O:34])[C:30]([CH3:33])([CH3:32])[CH3:31])[C:25]=3[Cl:24])=[N:10][C:8]=2[CH:9]=1)=[O:23])[CH3:43]