HRID1062986

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID118533

4-Bromo-2-nitroanisole

C7H6BrNO3

HCID643495

1-Cbz-Piperazine

C12H16N2O2

结构：COc1ccc(N2CCOCC2)c2sc(NC(=O)c3ccc(C)s3)nc12

HCID86584913

未命名化合物

PRODUCTS

生成物

结构：COc1ccc(N2CCN(C(=O)OCc3ccccc3)CC2)c2sc(NC(=O)c3ccc(C)s3)nc12

HCID86584912

未命名化合物

PROCEDURE

实验过程

The title compound was synthesized starting from N-benzyloxycarbonylpiperazine and 4-bromo-2-nitroanisole as described for 5-methyl-thiophene-2-carboxylic acid (4-methoxy-7-morpholin-4-yl-benzothiazol-2-yl)-amide and obtained as a white solid in 12% overall yield, MS: m/e=523 (M+H+).

WORKUP

后处理

customobtained as a white solid in 12% overall yield, MS

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-edd3f72864704307b4545edbf2b7e6ae
来源数据集: uspto-grants-2005_11
DOI: 10.6084/m9.figshare.5104873.v1
专利: US06963000B2
来源说明: uspto-grants-2005_11

反应 SMILES

[CH2:1]([O:8][C:9]([N:11]1[CH2:16][CH2:15][NH:14][CH2:13][CH2:12]1)=[O:10])[C:2]1[CH:7]=[CH:6][CH:5]=[CH:4][CH:3]=1.BrC1C=CC(OC)=C([N+]([O-])=O)C=1.[CH3:29][O:30][C:31]1[C:36]2[N:37]=[C:38]([NH:40][C:41]([C:43]3[S:44][C:45]([CH3:48])=[CH:46][CH:47]=3)=[O:42])[S:39][C:35]=2[C:34](N2CCOCC2)=[CH:33][CH:32]=1>>[CH2:1]([O:8][C:9]([N:11]1[CH2:16][CH2:15][N:14]([C:34]2[C:35]3[S:39][C:38]([NH:40][C:41]([C:43]4[S:44][C:45]([CH3:48])=[CH:46][CH:47]=4)=[O:42])=[N:37][C:36]=3[C:31]([O:30][CH3:29])=[CH:32][CH:33]=2)[CH2:13][CH2:12]1)=[O:10])[C:2]1[CH:7]=[CH:6][CH:5]=[CH:4][CH:3]=1