HRID905554

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：COc1ccc2c(OC3CC4C(=O)NC5(C(=O)O)CC5C=CCCCCN(C)C(=O)N4C3)nc(Cl)cc2c1

HCID76674825

未命名化合物

结构：COc1ccc2c(O)nc(-c3csc(NC(C)C)n3)cc2c1

HCID178487742

未命名化合物

PRODUCTS

生成物

结构：COc1ccc2c(OC3CC4C(=O)NC5(C(=O)O)CC5C=CCCCCN(C)C(=O)N4C3)nc(-c3csc(NC(C)C)n3)cc2c1

HCID76674824

未命名化合物

PROCEDURE

实验过程

The title product 71 was prepared from 1-hydroxy-3-(2-isopropylaminothiazol-4-yl)-6-methoxyisoquinoline following the same procedures described for the preparation of 17-(3-chloro-6-methoxyisoquinolin-1-yloxy)-13-methyl-2,14-dioxo-3,13,15-triazatricyclo[13.3.0.04,6]octadec-7-ene-4-carboxylic acid (42, Example 10): m/z=649 (M+H)+.

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f80fa376c38d41378121f64a1559a673
来源数据集: uspto-grants-2011_09
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08012939B2
来源说明: uspto-grants-2011_09

反应 SMILES

[OH:1][C:2]1[C:11]2[C:6](=[CH:7][C:8]([O:12][CH3:13])=[CH:9][CH:10]=2)[CH:5]=[C:4]([C:14]2[N:15]=[C:16]([NH:19][CH:20]([CH3:22])[CH3:21])[S:17][CH:18]=2)[N:3]=1.ClC1N=C(O[CH:37]2[CH2:54][CH:53]3[N:39]([C:40](=[O:60])[N:41]([CH3:59])[CH2:42][CH2:43][CH2:44][CH2:45][CH:46]=[CH:47][CH:48]4[C:50]([C:56]([OH:58])=[O:57])([NH:51][C:52]3=[O:55])[CH2:49]4)[CH2:38]2)C2C(C=1)=CC(OC)=CC=2>>[CH:20]([NH:19][C:16]1[S:17][CH:18]=[C:14]([C:4]2[N:3]=[C:2]([O:1][CH:37]3[CH2:54][CH:53]4[N:39]([C:40](=[O:60])[N:41]([CH3:59])[CH2:42][CH2:43][CH2:44][CH2:45][CH:46]=[CH:47][CH:48]5[C:50]([C:56]([OH:58])=[O:57])([NH:51][C:52]4=[O:55])[CH2:49]5)[CH2:38]3)[C:11]3[C:6]([CH:5]=2)=[CH:7][C:8]([O:12][CH3:13])=[CH:9][CH:10]=3)[N:15]=1)([CH3:22])[CH3:21]