HRID1407993

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8018

2-Methoxyethylamine

C3H9NO

结构：O=C(CCSCc1cccc(C(=O)Nc2ccc(N3CCCCC3)cc2-c2cc(C(=O)NCc3cccc(C(F)(F)F)c3)ccn2)c1)NCCN1CCOCC1

HCID66586771

未命名化合物

PRODUCTS

生成物

结构：COCCNC(=O)CCSCc1cccc(C(=O)Nc2ccc(N3CCCCC3)cc2-c2cc(C(=O)NCc3cccc(C(F)(F)F)c3)ccn2)c1

HCID66587936

未命名化合物

PROCEDURE

实验过程

This compound was prepared using the procedure described for the preparation of 2-(2-(3-(((3-((2-morpholinoethyl)amino)-3-oxopropyl)thio)methyl)benzamido)-5-(piperidin-1-yl)-phenyl)-N-(3-(trifluoromethyl)benzyl)isonicotinamide 4.16, using 2-methoxyethylamine in place of 2-morpholinoethylamine. MS (ES, m/z): 734 [M+H]+

WORKUP

后处理

customThis compound was prepared

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9e159df9706548308a33ba55e31b9762
来源数据集: uspto-grants-2014_12
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08916569B2
来源说明: uspto-grants-2014_12

反应 SMILES

O1CCN(C[CH2:8][NH:9][C:10](=[O:56])[CH2:11][CH2:12][S:13][CH2:14][C:15]2[CH:16]=[C:17]([CH:53]=[CH:54][CH:55]=2)[C:18]([NH:20][C:21]2[CH:26]=[CH:25][C:24]([N:27]3[CH2:32][CH2:31][CH2:30][CH2:29][CH2:28]3)=[CH:23][C:22]=2[C:33]2[CH:34]=[C:35]([CH:50]=[CH:51][N:52]=2)[C:36]([NH:38][CH2:39][C:40]2[CH:45]=[CH:44][CH:43]=[C:42]([C:46]([F:49])([F:48])[F:47])[CH:41]=2)=[O:37])=[O:19])CC1.[CH3:57][O:58][CH2:59]CN>>[CH3:57][O:58][CH2:59][CH2:8][NH:9][C:10](=[O:56])[CH2:11][CH2:12][S:13][CH2:14][C:15]1[CH:16]=[C:17]([CH:53]=[CH:54][CH:55]=1)[C:18]([NH:20][C:21]1[CH:26]=[CH:25][C:24]([N:27]2[CH2:28][CH2:29][CH2:30][CH2:31][CH2:32]2)=[CH:23][C:22]=1[C:33]1[CH:34]=[C:35]([CH:50]=[CH:51][N:52]=1)[C:36]([NH:38][CH2:39][C:40]1[CH:45]=[CH:44][CH:43]=[C:42]([C:46]([F:47])([F:48])[F:49])[CH:41]=1)=[O:37])=[O:19]