HRID879493

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID26369215

5-Bromo-1-methyl-1H-indazol-3-amine

C8H8BrN3

结构：CCOC(=O)[C@@H](OC(C)(C)C)c1c(C)cc2nc(-c3ccc4c(N)nn(C)c4c3)sc2c1-c1ccc(Cl)cc1

HCID86700305

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)[C@@H](OC(C)(C)C)c1c(C)cc2nc(-c3ccc4c(c3)c(N)nn4C)sc2c1-c1ccc(Cl)cc1

HCID86700310

未命名化合物

PROCEDURE

实验过程

Prepared in a manner similar to (S)-ethyl 2-(2-(3-amino-1-methyl-1H-indazol-6-yl)-7-(4-chlorophenyl)-5-methylbenzo[d]thiazol-6-yl)-2-tert-butoxyacetate except using 5-bromo-1-methyl-1H-indazol-3-amine instead of 6-bromo-1-methyl-1H-indazol-3-amine. LCMS-ESI+: calc'd for C30H31ClN4O3S: 563.2, 565.2 (M+H+); Found: 563.3, 565.2 (M+H+).

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7441b71de8ef4c81acaa9627aef6e49b
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

NC1C2C(=CC([C:11]3[S:12][C:13]4[C:19]([C:20]5[CH:25]=[CH:24][C:23]([Cl:26])=[CH:22][CH:21]=5)=[C:18]([C@H:27]([O:33][C:34]([CH3:37])([CH3:36])[CH3:35])[C:28]([O:30][CH2:31][CH3:32])=[O:29])[C:17]([CH3:38])=[CH:16][C:14]=4[N:15]=3)=CC=2)N(C)N=1.Br[C:41]1[CH:42]=[C:43]2[C:47](=[CH:48][CH:49]=1)[N:46]([CH3:50])[N:45]=[C:44]2[NH2:51]>>[NH2:51][C:44]1[C:43]2[C:47](=[CH:48][CH:49]=[C:41]([C:11]3[S:12][C:13]4[C:19]([C:20]5[CH:21]=[CH:22][C:23]([Cl:26])=[CH:24][CH:25]=5)=[C:18]([C@H:27]([O:33][C:34]([CH3:36])([CH3:35])[CH3:37])[C:28]([O:30][CH2:31][CH3:32])=[O:29])[C:17]([CH3:38])=[CH:16][C:14]=4[N:15]=3)[CH:42]=2)[N:46]([CH3:50])[N:45]=1