HRID400082

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8857

Ethyl acetate

C4H8O2

结构：CN1CCN(C(N)=O)CC1.O=C(O)C1(c2cccnc2)CCNCC1

HCID67648099

未命名化合物

结构：COc1cc(C(=O)N2CC[C@@](CCCS(=O)(=O)[O-])(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC

HCID86753250

未命名化合物

PRODUCTS

生成物

结构：CN1CCN(C(N)=O)CC1.COc1cc(C(=O)N2CC[C@](CCN3CCC(C(=O)O)(c4cccnc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC

HCID86753264

未命名化合物

AUXILIARIES

试剂、催化剂与溶剂

溶剂HCID21226129

未命名化合物

5 次

PROCEDURE

实验过程

Prepare by the method of Example 88.6 using (S)-2-[1-(3,4,5-trimethoxy-benzoyl)-3-(3,4-dichloro-phenyl)-pyrrolidin-3-yl]-ethyl-methanesulfonate and 4-(pyridin-3-yl)-piperidine-4-carboxylic acid 4-methylpiperazine-amide to give, after chromatography on silica gel eluting sequentially with ethyl acetate, 1% methanol/dichloromethane, 3% methanol/dichloromethane, 5% methanol/dichloromethane, 7% methanol/dichloromethane, and then 9% methanol/dichloromethane, the title compound: Rf =0.29 (silica gel, methanol/dichloromethane/concentrated ammonia 10/90/0.5).

WORKUP

后处理

customto give

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9b7f4da3389341b2b8e514cc7e6bf0da
来源数据集: uspto-grants-1998_10
DOI: 10.6084/m9.figshare.5104873.v1
专利: US05824690
来源说明: uspto-grants-1998_10

反应 SMILES

[CH3:1][O:2][C:3]1[CH:4]=[C:5]([CH:28]=[C:29]([O:33][CH3:34])[C:30]=1[O:31][CH3:32])[C:6]([N:8]1[CH2:12][CH2:11][C@@:10]([CH2:21][CH2:22]CS([O-])(=O)=O)([C:13]2[CH:18]=[CH:17][C:16]([Cl:19])=[C:15]([Cl:20])[CH:14]=2)[CH2:9]1)=[O:7].[CH3:35][N:36]1[CH2:41][CH2:40][N:39]([C:42]([NH2:44])=[O:43])[CH2:38][CH2:37]1.[N:45]1[CH:50]=[CH:49][CH:48]=[C:47]([C:51]2([C:57]([OH:59])=[O:58])[CH2:56][CH2:55][NH:54][CH2:53][CH2:52]2)[CH:46]=1.C(OCC)(=O)C>CO.ClCCl>[CH3:35][N:36]1[CH2:41][CH2:40][N:39]([C:42]([NH2:44])=[O:43])[CH2:38][CH2:37]1.[Cl:20][C:15]1[CH:14]=[C:13]([C@@:10]2([CH2:21][CH2:22][N:54]3[CH2:53][CH2:52][C:51]([C:47]4[CH:46]=[N:45][CH:50]=[CH:49][CH:48]=4)([C:57]([OH:59])=[O:58])[CH2:56][CH2:55]3)[CH2:11][CH2:12][N:8]([C:6](=[O:7])[C:5]3[CH:28]=[C:29]([O:33][CH3:34])[C:30]([O:31][CH3:32])=[C:3]([O:2][CH3:1])[CH:4]=3)[CH2:9]2)[CH:18]=[CH:17][C:16]=1[Cl:19]