HRID2253480

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID67944

2-Benzothiazolesulfonamide

C7H6N2O2S2

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

HCID3036152

未命名化合物

PRODUCTS

生成物

结构：CCC(=C(c1ccccc1)c1ccc(C=CC(=O)NS(=O)(=O)c2nc3ccccc3s2)cc1)c1ccccc1

HCID72625150

未命名化合物

PROCEDURE

实验过程

Prepared by coupling 1a and 2-benzothiazolesulfonamide (J Org Chem, 1958, 1768) in accordance with Procedure 1, Method A described hereinabove. Yield (52%); 1H NMR (d6-DMSO) δ 8.07 (d, J=8.3 Hz, 1H), 7.99 (d, J=8.3 Hz, 1H), 7.53-7.05 (m, 15H), 6.78 (d, J=8.1 Hz, 2H), 6.27 (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: 551 (M+H+).

WORKUP

后处理

customPrepared
customYield (52%)

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9d6496aba9b646318ee04a525ebfe57a
来源数据集: uspto-grants-2008_01
DOI: 10.6084/m9.figshare.5104873.v1
专利: US07323587B2
来源说明: uspto-grants-2008_01

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.[S:28]1[C:32]2[CH:33]=[CH:34][CH:35]=[CH:36][C:31]=2[N:30]=[C:29]1[S:37]([NH2:40])(=[O:39])=[O:38]>>[C:1]1([C:7]([C:17]2[CH:22]=[CH:21][C:20]([CH:23]=[CH:24][C:25]([NH:40][S:37]([C:29]3[S:28][C:32]4[CH:33]=[CH:34][CH:35]=[CH:36][C:31]=4[N:30]=3)(=[O:39])=[O:38])=[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