HRID1944916

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID4837

Piperazine

C4H10N2

结构：COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(S(=O)(=O)c4cccc(C(=O)NCCCCCCCCO)c4)cc23)c1

HCID66988028

未命名化合物

PRODUCTS

生成物

结构：COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(S(=O)(=O)c4cccc(C(=O)N5CCNCC5)c4)cc23)c1

HCID66988311

未命名化合物

PROCEDURE

实验过程

The title compound was synthesized in a manner analogous to that described for Intermediate 70, using piperazine in place of 8-aminooctanol. ES/MS calcd. for C29H30N5O5S+ 560.2. Found m/z=560.2 (M+H)+.

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8d1e156baba44e9a816a863d902115e2
来源数据集: uspto-grants-2013_03
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08394829B2
来源说明: uspto-grants-2013_03

反应 SMILES

OCCCCCC[CH2:8][CH2:9][NH:10][C:11]([C:13]1[CH:14]=[C:15]([S:19]([C:22]2[CH:23]=[C:24]3[C:29](=[C:30]([CH3:32])[CH:31]=2)[N:28]=[CH:27][C:26]([C:33]([NH2:35])=[O:34])=[C:25]3[NH:36][C:37]2[CH:42]=[CH:41][CH:40]=[C:39]([O:43][CH3:44])[CH:38]=2)(=[O:21])=[O:20])[CH:16]=[CH:17][CH:18]=1)=[O:12].[NH:45]1CCN[CH2:47][CH2:46]1>>[CH3:44][O:43][C:39]1[CH:38]=[C:37]([NH:36][C:25]2[C:24]3[C:29](=[C:30]([CH3:32])[CH:31]=[C:22]([S:19]([C:15]4[CH:16]=[CH:17][CH:18]=[C:13]([C:11]([N:10]5[CH2:47][CH2:46][NH:45][CH2:8][CH2:9]5)=[O:12])[CH:14]=4)(=[O:21])=[O:20])[CH:23]=3)[N:28]=[CH:27][C:26]=2[C:33]([NH2:35])=[O:34])[CH:42]=[CH:41][CH:40]=1