HRID59793

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11430

Potassium Carbonate

CK2O3

HCID24654

Hydrazine hydrate (1:1)

H6N2O

结构：CC(=O)NS(=O)(=O)c1ccc(CN(CCc2ccc(Br)cc2)C2CCNCC2)cc1.Cl

HCID121410314

未命名化合物

HCID131737066

未命名化合物

PRODUCTS

生成物

结构：CC(=O)NS(=O)(=O)c1ccc(CN(CCc2ccc(Br)cc2)C2CCN(c3nc(N)n[nH]3)CC2)cc1

HCID178475154

未命名化合物

PROCEDURE

实验过程

N-((4-(((4-Bromophenethyl)(piperidin-4-yl)amino)methyl)phenyl)sulfonyl)acetamide hydrochloride obtained in Step 2 was reacted with K2CO3 and S,S′-dimethyl-N-cyano-dithioiminocarbonate, followed by the cyclization of the intermediate (N-cyanopiperazine-1-carbimidothioate) with hydrazine monohydrate in a manner described in Procedure 3.

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d1c81bf415924904b5e3a8cac6d77f51
来源数据集: uspto-grants-2016_09
DOI: 10.6084/m9.figshare.5104873.v1
专利: US09440953B2
来源说明: uspto-grants-2016_09

反应 SMILES

Cl.[Br:2][C:3]1[CH:31]=[CH:30][C:6]([CH2:7][CH2:8][N:9]([CH2:16][C:17]2[CH:22]=[CH:21][C:20]([S:23]([NH:26][C:27](=[O:29])[CH3:28])(=[O:25])=[O:24])=[CH:19][CH:18]=2)[CH:10]2[CH2:15][CH2:14][NH:13][CH2:12][CH2:11]2)=[CH:5][CH:4]=1.C([O-])([O-])=O.[K+].[K+].[C:38]([N:40]=[C:41]([N:43]1CCNCC1)[S-])#[N:39].O.[NH2:50]N>>[NH2:50][C:41]1[N:40]=[C:38]([N:13]2[CH2:14][CH2:15][CH:10]([N:9]([CH2:16][C:17]3[CH:22]=[CH:21][C:20]([S:23]([NH:26][C:27](=[O:29])[CH3:28])(=[O:25])=[O:24])=[CH:19][CH:18]=3)[CH2:8][CH2:7][C:6]3[CH:30]=[CH:31][C:3]([Br:2])=[CH:4][CH:5]=3)[CH2:11][CH2:12]2)[NH:39][N:43]=1