HRID2109187

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID186003

3-Ethynylpyridine

C7H5N

结构：COc1c(NC(=O)c2cc(F)c(C)c(N=[N+]=[N-])c2)cc(C(C)(C)C)cc1NS(C)(=O)=O

HCID17973068

未命名化合物

PRODUCTS

生成物

结构：COc1c(NC(=O)c2cc(F)c(C)c(-n3cc(-c4cccnc4)nn3)c2)cc(C(C)(C)C)cc1NS(C)(=O)=O

HCID21097182

未命名化合物

PROCEDURE

实验过程

Example 21 was prepared from 3-azido-N-(5-tert-butyl-3-methanesulfonylamino-2-methoxy-phenyl)-5-fluoro-4-methyl-benzamide and 3-ethynyl-pyridine in the same manner as Example 15. ESI MS m/z 553 [C27H29FN6O4S+H]+.

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9a89bee680ea44b3bdc9ab48978e7f0e
来源数据集: uspto-grants-2009_04
DOI: 10.6084/m9.figshare.5104873.v1
专利: US07514458B2
来源说明: uspto-grants-2009_04

反应 SMILES

[N:1]([C:4]1[CH:5]=[C:6]([CH:27]=[C:28]([F:31])[C:29]=1[CH3:30])[C:7]([NH:9][C:10]1[CH:15]=[C:14]([C:16]([CH3:19])([CH3:18])[CH3:17])[CH:13]=[C:12]([NH:20][S:21]([CH3:24])(=[O:23])=[O:22])[C:11]=1[O:25][CH3:26])=[O:8])=[N+:2]=[N-:3].[C:32]([C:34]1[CH:35]=[N:36][CH:37]=[CH:38][CH:39]=1)#[CH:33]>>[C:16]([C:14]1[CH:13]=[C:12]([NH:20][S:21]([CH3:24])(=[O:22])=[O:23])[C:11]([O:25][CH3:26])=[C:10]([NH:9][C:7](=[O:8])[C:6]2[CH:5]=[C:4]([N:1]3[CH:33]=[C:32]([C:34]4[CH:35]=[N:36][CH:37]=[CH:38][CH:39]=4)[N:3]=[N:2]3)[C:29]([CH3:30])=[C:28]([F:31])[CH:27]=2)[CH:15]=1)([CH3:19])([CH3:18])[CH3:17]