HRID28989

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：CN1CCc2ccc(-c3cc4c(Br)ccnc4n3S(=O)(=O)c3ccccc3)cc2C1

HCID68997057

未命名化合物

结构：CCn1cc(Br)c(-c2ccc(NC(=O)N(C)C)cc2)n1

HCID68999367

未命名化合物

PRODUCTS

生成物

结构：CCn1cc(-c2ccnc3c2cc(-c2ccc4c(c2)CN(C)CC4)n3S(=O)(=O)c2ccccc2)c(-c2ccc(NC(=O)N(C)C)cc2)n1

HCID69001000

未命名化合物

PROCEDURE

实验过程

Following the procedure described for Intermediate 32 with 7-[4-bromo-1-(phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridin-2-yl]-2-methyl-1,2,3,4-tetrahydroisoquinoline. Using this product crude and following the procedure described for Intermediate 100 using N′-[4-(4-bromo-1-ethyl-1H-pyrazol-3-yl)phenyl]-N,N-dimethylurea and stirring for 4.5 hours provided the title compound. ESMS [M+H]+: 660.6.

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9724f2b1e9bd424bbf59f7df1cd47d89
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

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