HRID1071696

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11229529

1-Chloroethyl Cyclohexyl Carbonate

C9H15ClO3

结构：CC(C)N1CCC(NC(=O)c2cc3c(C(=O)O)cccc3n2Cc2cc(-c3ccc(Cl)s3)on2)CC1

HCID20801098

未命名化合物

PRODUCTS

生成物

结构：CC(OC(=O)OC1CCCCC1)OC(=O)c1cccc2c1cc(C(=O)NC1CCN(C(C)C)CC1)n2Cc1cc(-c2ccc(Cl)s2)on1

HCID20801161

未命名化合物

PROCEDURE

实验过程

can be prepared from 1-[5-(5-Chloro-thiophen-2-yl)-isoxazol-3-ylmethyl]-2-(1-isopropyl-piperidin-4-ylcarbamoyl)-1H-indole-4-carboxylic acid and cyclohexyl 1-chloroethyl carbonate by the procedure described by K. Kubo et al., J. Med. Chem. 1993, 36, 2343-2349.

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d6a35eb506e24871bb6eb7dd6ead8c93
来源数据集: uspto-grants-2005_06
DOI: 10.6084/m9.figshare.5104873.v1
专利: US06906084B2
来源说明: uspto-grants-2005_06

反应 SMILES

[Cl:1][C:2]1[S:6][C:5]([C:7]2[O:11][N:10]=[C:9]([CH2:12][N:13]3[C:21]4[CH:20]=[CH:19][CH:18]=[C:17]([C:22]([OH:24])=[O:23])[C:16]=4[CH:15]=[C:14]3[C:25](=[O:36])[NH:26][CH:27]3[CH2:32][CH2:31][N:30]([CH:33]([CH3:35])[CH3:34])[CH2:29][CH2:28]3)[CH:8]=2)=[CH:4][CH:3]=1.[C:37](=[O:49])([O:45][CH:46](Cl)[CH3:47])[O:38][CH:39]1[CH2:44][CH2:43][CH2:42][CH2:41][CH2:40]1>>[CH:39]1([O:38][C:37]([O:45][CH:46]([O:23][C:22]([C:17]2[C:16]3[CH:15]=[C:14]([C:25](=[O:36])[NH:26][CH:27]4[CH2:32][CH2:31][N:30]([CH:33]([CH3:34])[CH3:35])[CH2:29][CH2:28]4)[N:13]([CH2:12][C:9]4[CH:8]=[C:7]([C:5]5[S:6][C:2]([Cl:1])=[CH:3][CH:4]=5)[O:11][N:10]=4)[C:21]=3[CH:20]=[CH:19][CH:18]=2)=[O:24])[CH3:47])=[O:49])[CH2:44][CH2:43][CH2:42][CH2:41][CH2:40]1