HRID879317

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：COC(=O)[C@@H](OC(C)(C)C)c1c(C)cc2nc(-n3cccc(-c4ccc5c(cnn5C)c4)c3=O)sc2c1-c1ccc(Cl)cc1

HCID86699834

未命名化合物

HCID86699835

未命名化合物

PRODUCTS

生成物

结构：COC(=O)[C@@H](OC(C)(C)C)c1c(C)cc2nc(-n3cc(-c4ccc5c(cnn5C)c4)ccc3=O)sc2c1-c1ccc(Cl)cc1

HCID86699836

未命名化合物

PROCEDURE

实验过程

Compound (S)-methyl 2-tert-butoxy-2-(7-(4-chlorophenyl)-5-methyl-2-(5-(1-methyl-1H-indazol-5-yl)-2-oxopyridin-1(2H)-yl)benzo[d]thiazol-6-yl)acetate was prepared following the procedure used to prepare (S)-methyl 2-tert-butoxy-2-(7-(4-chlorophenyl)-5-methyl-2-(3-(1-methyl-1H-indazol-5-yl)-2-oxopyridin-1(2H)-yl)benzo[d]thiazol-6-yl)acetate of Example 27, except that 5-(1-methyl-1H-indazol-5-yl)pyridin-2(1H)-one was used instead of 3-(1-methyl-1H-indazol-5-yl)pyridin-2(1H)-one. LCMS-ESI+ (m/z): [M+H]+ calcd for C34H32ClN4O4S: 627.18; Found: 627.2.

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-0fc454cf2ff74ed0978b1eae6e21cdf2
来源数据集: uspto-grants-2015_03
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08987250B2
来源说明: uspto-grants-2015_03

反应 SMILES

[C:1]([O:5][C@@H:6]([C:11]1[C:36]([CH3:37])=[CH:35][C:14]2[N:15]=[C:16]([N:18]3[CH:23]=[CH:22][CH:21]=[C:20](C4C=C5C(=CC=4)N(C)N=C5)[C:19]3=[O:34])[S:17][C:13]=2[C:12]=1[C:38]1[CH:43]=[CH:42][C:41]([Cl:44])=[CH:40][CH:39]=1)[C:7]([O:9][CH3:10])=[O:8])([CH3:4])([CH3:3])[CH3:2].[CH3:45][N:46]1[C:54]2[C:49](=[CH:50][C:51](C3C=CC(=O)NC=3)=[CH:52][CH:53]=2)[CH:48]=[N:47]1>>[C:1]([O:5][C@@H:6]([C:11]1[C:36]([CH3:37])=[CH:35][C:14]2[N:15]=[C:16]([N:18]3[CH:23]=[C:22]([C:51]4[CH:50]=[C:49]5[C:54](=[CH:53][CH:52]=4)[N:46]([CH3:45])[N:47]=[CH:48]5)[CH:21]=[CH:20][C:19]3=[O:34])[S:17][C:13]=2[C:12]=1[C:38]1[CH:39]=[CH:40][C:41]([Cl:44])=[CH:42][CH:43]=1)[C:7]([O:9][CH3:10])=[O:8])([CH3:3])([CH3:4])[CH3:2]