HRID1958735

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：CCOc1ccc(S(=O)(=O)Cl)cc1NC(=O)N1CCOCC1

HCID2758760

未命名化合物

HCID46223508

未命名化合物

PRODUCTS

生成物

结构：CCOc1ccc(S(=O)(=O)N[C@H](CC(=O)OCc2ccccc2)CN(C)C)cc1NC(=O)N1CCOCC1

HCID86641228

未命名化合物

收率 68%

PROCEDURE

实验过程

According to the method described in example S72a, (R)-benzyl 3-amino-4-(dimethylamino)butanoate (30 mg, 0.086 mmol) was reacted with 4-ethoxy-3-(morpholine-4-carboxamido)benzene-1-sulfonyl chloride to yield the title compound as a white solid (32 mg, 68%). MS ESI 549.3 [M+H]+, calcd for [C26H36N4O7S+H]+ 549.23

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6dadd6ba4e0d4eddacf8c62886fd767a
来源数据集: uspto-grants-2013_04
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08410150B2
来源说明: uspto-grants-2013_04

反应 SMILES

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