HRID64144

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID2760919

Cyclopropanesulfonyl chloride

C3H5ClO2S

结构：CC(=O)Nc1cc(-c2ccc(F)cc2F)cc(-n2cnc3cc(-c4cn(C5CCN(C)CC5)nn4)ccc32)c1

HCID117777724

未命名化合物

PRODUCTS

生成物

结构：CN1CCC(n2cc(-c3ccc4c(c3)ncn4-c3cc(NS(=O)(=O)C4CC4)cc(-c4ccc(F)cc4F)c3)nn2)CC1

HCID117777526

未命名化合物

PROCEDURE

实验过程

The compound was prepared from the compound of Example 164 using the procedures of Example 165 and cyclopropane sulfonyl chloride. LC-MS (ESI): Calculated mass: 553.61; Observed mass: 554.2 [M+H]+ (rt: 0.57 min).

WORKUP

后处理

custom554.2 [M+H]+ (rt: 0.57 min)

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-94165eb988184224a27a1898e1196049
来源数据集: uspto-grants-2016_09
DOI: 10.6084/m9.figshare.5104873.v1
专利: US09447091B2
来源说明: uspto-grants-2016_09

反应 SMILES

[F:1][C:2]1[CH:7]=[C:6]([F:8])[CH:5]=[CH:4][C:3]=1[C:9]1[CH:14]=[C:13]([N:15]2[C:19]3[CH:20]=[CH:21][C:22]([C:24]4[N:25]=[N:26][N:27]([CH:29]5[CH2:34][CH2:33][N:32]([CH3:35])[CH2:31][CH2:30]5)[CH:28]=4)=[CH:23][C:18]=3[N:17]=[CH:16]2)[CH:12]=[C:11]([NH:36]C(=O)C)[CH:10]=1.[CH:40]1([S:43](Cl)(=[O:45])=[O:44])[CH2:42][CH2:41]1>>[F:1][C:2]1[CH:7]=[C:6]([F:8])[CH:5]=[CH:4][C:3]=1[C:9]1[CH:14]=[C:13]([N:15]2[C:19]3[CH:20]=[CH:21][C:22]([C:24]4[N:25]=[N:26][N:27]([CH:29]5[CH2:34][CH2:33][N:32]([CH3:35])[CH2:31][CH2:30]5)[CH:28]=4)=[CH:23][C:18]=3[N:17]=[CH:16]2)[CH:12]=[C:11]([NH:36][S:43]([CH:40]2[CH2:42][CH2:41]2)(=[O:45])=[O:44])[CH:10]=1