HRID1824876

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID244076

3-(Trifluoromethyl)benzenesulfonamide

C7H6F3NO2S

$结构：CC/C(=C(\c1ccccc1)c1ccc(C=CC(=O)O)cc1)c1ccccc1$

HCID3036152

未命名化合物

PRODUCTS

生成物

结构：CCC(=C(c1ccccc1)c1ccc(C=CC(=O)NS(=O)(=O)c2cccc(C(F)(F)F)c2)cc1)c1ccccc1

HCID69781535

未命名化合物

PROCEDURE

实验过程

Prepared by coupling 1a and 3-(trifluoromethyl)-benzenesulfonamide (Synlett, 1997, 375) in accordance with Procedure 1, Method B described hereinabove. Yield (35%); 1H NMR (d6-DMSO) δ 8.22–8.08 (m, 3H), 7.86 (t, J=7.7 Hz, 1H), 7.42–7.07 (m, 13H), 6.84 (d, J=8.0 Hz, 2H), 6.40 (d, J=15.7 Hz, 1H), 2.35 (q, J=7.3 Hz, 2H), 0.82 (t, J=7.3 Hz, 3H); APcI m/z: 562 (M+H+).

WORKUP

后处理

customPrepared
customYield (35%)

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-658477b9fa364147b282c33891b28eb2
来源数据集: uspto-grants-2006_05
DOI: 10.6084/m9.figshare.5104873.v1
专利: US07045540B2
来源说明: uspto-grants-2006_05

反应 SMILES

[C:1]1(/[C:7](/[C:17]2[CH:22]=[CH:21][C:20]([CH:23]=[CH:24][C:25](O)=[O:26])=[CH:19][CH:18]=2)=[C:8](/[C:11]2[CH:16]=[CH:15][CH:14]=[CH:13][CH:12]=2)\[CH2:9][CH3:10])[CH:6]=[CH:5][CH:4]=[CH:3][CH:2]=1.[F:28][C:29]([F:41])([F:40])[C:30]1[CH:31]=[C:32]([S:36]([NH2:39])(=[O:38])=[O:37])[CH:33]=[CH:34][CH:35]=1>>[C:1]1([C:7]([C:17]2[CH:22]=[CH:21][C:20]([CH:23]=[CH:24][C:25]([NH:39][S:36]([C:32]3[CH:33]=[CH:34][CH:35]=[C:30]([C:29]([F:28])([F:40])[F:41])[CH:31]=3)(=[O:38])=[O:37])=[O:26])=[CH:19][CH:18]=2)=[C:8]([C:11]2[CH:16]=[CH:15][CH:14]=[CH:13][CH:12]=2)[CH2:9][CH3:10])[CH:2]=[CH:3][CH:4]=[CH:5][CH:6]=1