HRID1797980

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID965875

1-(Cyclopropylmethyl)piperazine

C8H16N2

结构：N#Cc1cccc(NC(=O)Nc2ccc(S(=O)(=O)NCc3ccc(S(N)(=O)=O)cc3)cc2)c1

HCID57496180

未命名化合物

PRODUCTS

生成物

结构：N=C(c1cccc(NC(=O)Nc2ccc(S(=O)(=O)NCc3ccc(S(N)(=O)=O)cc3)cc2)c1)N1CCN(CC2CC2)CC1

HCID57496167

未命名化合物

收率 57%

PROCEDURE

实验过程

The title compound was prepared from 4-(3-(3-cyanophenyl)ureido)-N-(4-sulfamoylbenzyl)benzenesulfonamide following procedure C and using 2.2 equivalent of 1-(cyclopropylmethyl)piperazine as secondary amine. The product was purified by preparative HPLC.

WORKUP

后处理

customThe product was purified by preparative HPLC

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b6ca31e5cd6c4845b1352b94edd1316c
来源数据集: uspto-grants-2013_01
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08343963B2
来源说明: uspto-grants-2013_01

反应 SMILES

[C:1]([C:3]1[CH:4]=[C:5]([NH:9][C:10](=[O:33])[NH:11][C:12]2[CH:17]=[CH:16][C:15]([S:18]([NH:21][CH2:22][C:23]3[CH:28]=[CH:27][C:26]([S:29](=[O:32])(=[O:31])[NH2:30])=[CH:25][CH:24]=3)(=[O:20])=[O:19])=[CH:14][CH:13]=2)[CH:6]=[CH:7][CH:8]=1)#[N:2].[CH:34]1([CH2:37][N:38]2[CH2:43][CH2:42][NH:41][CH2:40][CH2:39]2)[CH2:36][CH2:35]1>>[CH:34]1([CH2:37][N:38]2[CH2:43][CH2:42][N:41]([C:1](=[NH:2])[C:3]3[CH:4]=[C:5]([NH:9][C:10](=[O:33])[NH:11][C:12]4[CH:17]=[CH:16][C:15]([S:18]([NH:21][CH2:22][C:23]5[CH:28]=[CH:27][C:26]([S:29](=[O:31])(=[O:32])[NH2:30])=[CH:25][CH:24]=5)(=[O:20])=[O:19])=[CH:14][CH:13]=4)[CH:6]=[CH:7][CH:8]=3)[CH2:40][CH2:39]2)[CH2:36][CH2:35]1