HRID28994

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID8072

2-(Ethylamino)ethanol

C4H11NO

结构：Cn1cc(-c2ccnc3c2cc(-c2ccc(C=O)cc2)n3S(=O)(=O)c2ccccc2)c(-c2ccc(NC(=O)N3CCCC3)cc2)n1

HCID86613331

未命名化合物

PRODUCTS

生成物

结构：CCN(CCO)Cc1ccc(-c2cc3c(-c4cn(C)nc4-c4ccc(NC(=O)N5CCCC5)cc4)ccnc3n2S(=O)(=O)c2ccccc2)cc1

HCID68995203

未命名化合物

AUXILIARIES

试剂、催化剂与溶剂

溶剂HCID6365

1,1-Dichloroethane

C2H4Cl2

PROCEDURE

实验过程

Following the procedure described in Intermediate 101 using N-(4-{4-[2-(4-formylphenyl)-1-(phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridin-4-yl]-1-methyl-1H-pyrazol-3-yl}phenyl)-1-pyrrolidinecarboxamide and 2-(ethylamino)ethanol in dichloroethane (instead of dichloromethane) provided the title compound. ESMS [M+H]+: 704.6.

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f4985b76c5d44cef98a32857244b41e3
来源数据集: uspto-grants-2008_09
DOI: 10.6084/m9.figshare.5104873.v1
专利: US07419988B2
来源说明: uspto-grants-2008_09

反应 SMILES

[CH:1]([C:3]1[CH:8]=[CH:7][C:6]([C:9]2[N:37]([S:38]([C:41]3[CH:46]=[CH:45][CH:44]=[CH:43][CH:42]=3)(=[O:40])=[O:39])[C:12]3=[N:13][CH:14]=[CH:15][C:16]([C:17]4[C:18]([C:23]5[CH:28]=[CH:27][C:26]([NH:29][C:30]([N:32]6[CH2:36][CH2:35][CH2:34][CH2:33]6)=[O:31])=[CH:25][CH:24]=5)=[N:19][N:20]([CH3:22])[CH:21]=4)=[C:11]3[CH:10]=2)=[CH:5][CH:4]=1)=O.[CH2:47]([NH:49][CH2:50][CH2:51][OH:52])[CH3:48].ClCCl>ClC(Cl)C>[CH2:47]([N:49]([CH2:1][C:3]1[CH:8]=[CH:7][C:6]([C:9]2[N:37]([S:38]([C:41]3[CH:46]=[CH:45][CH:44]=[CH:43][CH:42]=3)(=[O:39])=[O:40])[C:12]3=[N:13][CH:14]=[CH:15][C:16]([C:17]4[C:18]([C:23]5[CH:24]=[CH:25][C:26]([NH:29][C:30]([N:32]6[CH2:36][CH2:35][CH2:34][CH2:33]6)=[O:31])=[CH:27][CH:28]=5)=[N:19][N:20]([CH3:22])[CH:21]=4)=[C:11]3[CH:10]=2)=[CH:5][CH:4]=1)[CH2:50][CH2:51][OH:52])[CH3:48]