HRID902815

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID67607

Benzoyl chloride, 4-(trifluoromethyl)-

C8H4ClF3O

HCID83242

4-Phenylbutylamine

C10H15N

HCID16770770

Methyl [4-(aminomethyl)phenoxy]acetate

C10H13NO3

HCID58693699

未命名化合物

PRODUCTS

生成物

结构：O=C(O)COc1ccc(CN(Cc2csc(-c3ccc(C(=O)NCCCCc4ccccc4)cc3)n2)C(=O)c2ccc(C(F)(F)F)cc2)cc1

HCID11456762

未命名化合物

PROCEDURE

实验过程

The title compound was prepared following the procedure A using 4-phenylbutylamine, 4-[4-(chloromethyl)-1,3-thiazol-2-yl]benzoyl chloride, 4-(trifluoromethyl)benzoyl chloride and methyl[4-(aminomethyl)phenoxy]acetate, acetate salt. M+(ESI): 702

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ea2dfb059694407b91ba87a2537e1fdf
来源数据集: uspto-grants-2008_04
DOI: 10.6084/m9.figshare.5104873.v1
专利: US07365225B2
来源说明: uspto-grants-2008_04

反应 SMILES

[C:1]1([CH2:7][CH2:8][CH2:9][CH2:10][NH2:11])[CH:6]=[CH:5][CH:4]=[CH:3][CH:2]=1.Cl[CH2:13][C:14]1[N:15]=[C:16]([C:19]2[CH:27]=[CH:26][C:22]([C:23](Cl)=[O:24])=[CH:21][CH:20]=2)[S:17][CH:18]=1.[F:28][C:29]([F:40])([F:39])[C:30]1[CH:38]=[CH:37][C:33]([C:34](Cl)=[O:35])=[CH:32][CH:31]=1.C[O:42][C:43](=[O:54])[CH2:44][O:45][C:46]1[CH:51]=[CH:50][C:49]([CH2:52][NH2:53])=[CH:48][CH:47]=1>>[C:1]1([CH2:7][CH2:8][CH2:9][CH2:10][NH:11][C:23]([C:22]2[CH:26]=[CH:27][C:19]([C:16]3[S:17][CH:18]=[C:14]([CH2:13][N:53]([CH2:52][C:49]4[CH:50]=[CH:51][C:46]([O:45][CH2:44][C:43]([OH:54])=[O:42])=[CH:47][CH:48]=4)[C:34](=[O:35])[C:33]4[CH:37]=[CH:38][C:30]([C:29]([F:40])([F:39])[F:28])=[CH:31][CH:32]=4)[N:15]=3)=[CH:20][CH:21]=2)=[O:24])[CH:6]=[CH:5][CH:4]=[CH:3][CH:2]=1