HRID1864370

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID2777786

1-[3-(Trifluoromethyl)-2-pyridinyl]piperazine

C10H12F3N3

反应SMILES：COc1cccc(S(=O)(=O)N2CC(C(=O)O)N(c3ccccc3)C2=O)c1

HCID67141122

未命名化合物

PRODUCTS

产物

反应SMILES：COc1cccc(S(=O)(=O)N2CC(C(=O)N3CCN(c4ncccc4C(F)(F)F)CC3)N(c3ccccc3)C2=O)c1

HCID25027711

未命名化合物

PROCEDURE

实验过程

In analogy to example 1, (RS)-1-(3-methoxy-benzenesulfonyl)-2-oxo-3-phenyl-imidazolidine-4-carboxylic acid (step 4 of example 1) was reacted with 1-[3-(trifluoromethyl)pyrid-2-yl]-piperazine to give the title compound as a colorless solid. MS: 589.8 ([M+H]+)

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-1186e64e57054ec7a1b5416988b9f3b2
来源数据集: uspto-grants-2009_12
DOI: 10.6084/m9.figshare.5104873.v1
专利号: US07625902B2
来源说明: uspto-grants-2009_12

反应SMILES

[CH3:1][O:2][C:3]1[CH:4]=[C:5]([S:9]([N:12]2[CH2:16][CH:15]([C:17]([OH:19])=O)[N:14]([C:20]3[CH:25]=[CH:24][CH:23]=[CH:22][CH:21]=3)[C:13]2=[O:26])(=[O:11])=[O:10])[CH:6]=[CH:7][CH:8]=1.[F:27][C:28]([F:42])([F:41])[C:29]1[C:30]([N:35]2[CH2:40][CH2:39][NH:38][CH2:37][CH2:36]2)=[N:31][CH:32]=[CH:33][CH:34]=1>>[CH3:1][O:2][C:3]1[CH:4]=[C:5]([S:9]([N:12]2[CH2:16][CH:15]([C:17]([N:38]3[CH2:39][CH2:40][N:35]([C:30]4[C:29]([C:28]([F:42])([F:27])[F:41])=[CH:34][CH:33]=[CH:32][N:31]=4)[CH2:36][CH2:37]3)=[O:19])[N:14]([C:20]3[CH:25]=[CH:24][CH:23]=[CH:22][CH:21]=3)[C:13]2=[O:26])(=[O:11])=[O:10])[CH:6]=[CH:7][CH:8]=1