HRID1799131

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID58551883

未命名化合物

HCID58551888

未命名化合物

PRODUCTS

生成物

结构：COCC#Cc1sc(-c2ccccc2)nc1C(=O)Nc1ccccc1-c1nc2cc(CN3CCCC3)cnc2s1

HCID46245048

未命名化合物

收率 30%

PROCEDURE

实验过程

The title compound was prepared according to amide synthesis general method A, utilizing 2-(6-(pyrrolidin-1-ylmethyl)thiazolo[5,4-b]pyridin-2-yl)aniline and 5-(3-methoxyprop-1-ynyl)-2-phenylthiazole-4-carboxylic acid. The product was isolated using workup 2 and purified by silica gel chromatography (gradient 0 to 10% methanol in CH2Cl2) followed by recrystallization from MeOH to give the title compound (111 mg, 30% yield). MS Calcd for C31H27N5O2S2: 565.16. Found (M+H)+ m/z=566.

WORKUP

后处理

customThe title compound was prepared
customThe product was isolated
custompurified by silica gel chromatography (gradient 0 to 10% methanol in CH2Cl2)
customfollowed by recrystallization from MeOH

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-0e1932626be1443ea2033f4e94ffdf9a
来源数据集: uspto-grants-2013_01
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08343997B2
来源说明: uspto-grants-2013_01

反应 SMILES

[N:1]1([CH2:6][C:7]2[CH:8]=[C:9]3[N:15]=[C:14]([C:16]4[CH:22]=[CH:21][CH:20]=[CH:19][C:17]=4[NH2:18])[S:13][C:10]3=[N:11][CH:12]=2)[CH2:5][CH2:4][CH2:3][CH2:2]1.[CH3:23][O:24][CH2:25][C:26]#[C:27][C:28]1[S:32][C:31]([C:33]2[CH:38]=[CH:37][CH:36]=[CH:35][CH:34]=2)=[N:30][C:29]=1[C:39](O)=[O:40]>>[CH3:23][O:24][CH2:25][C:26]#[C:27][C:28]1[S:32][C:31]([C:33]2[CH:34]=[CH:35][CH:36]=[CH:37][CH:38]=2)=[N:30][C:29]=1[C:39]([NH:18][C:17]1[CH:19]=[CH:20][CH:21]=[CH:22][C:16]=1[C:14]1[S:13][C:10]2[C:9]([N:15]=1)=[CH:8][C:7]([CH2:6][N:1]1[CH2:2][CH2:3][CH2:4][CH2:5]1)=[CH:12][N:11]=2)=[O:40]