HRID2185874

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID2753162

5,6,7,8-Tetrahydronaphthalene-1-carbonyl chloride

C11H11ClO

结构：CNC[C@@H](CCN1CCC(N2CCCNC2=O)CC1)c1ccc(Cl)c(Cl)c1

HCID11464101

未命名化合物

PRODUCTS

生成物

结构：CN(C[C@@H](CCN1CCC(N2CCCNC2=O)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cccc2c1CCCC2

HCID70160988

未命名化合物

PROCEDURE

实验过程

Using standard acylation conditions N-[(S)-2-(3,4-dichlorophenyl)4-[4-[tetrahydro-2-oxo-1(2H)-pyrimidinyl]-1-piperidinyl]butyl]-N-methylamine (S. C. Miller,. WO 9505377) was reacted with 5,6,7,8-tetrahydro-1-naphthalenecarbonyl chloride (Example 1) and the product was converted to the citrate salt MS: m/z 571 (M+H). Analysis for C31H40O2Cl2N4.C6H8O7.3.0H2O: calculated: C,54.34; H, 6.66; N, 6.85; found: C, 54.26; H, 5.97; N, 6.47.

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3b3d3f3771f2434896df718cb8264469
来源数据集: uspto-grants-2002_06
DOI: 10.6084/m9.figshare.5104873.v1
专利: US06403601B1
来源说明: uspto-grants-2002_06

反应 SMILES

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