HRID1410529

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6183612

(2E)-3-(2,3-Dihydro-1H-inden-5-yl)-2-propenoic acid

C12H12O2

结构：Cl.Cl.NC(=O)C(NC1CCC(c2c[nH]c3ccccc23)CC1)C1CCNCC1

HCID67775194

未命名化合物

PRODUCTS

生成物

结构：NC(=O)C(NC1CCC(c2c[nH]c3ccccc23)CC1)C1CCN(C(=O)/C=C/c2ccc3c(c2)CCC3)CC1

HCID57343818

未命名化合物

PROCEDURE

实验过程

The title compound was prepared from the product of Example 1, step J, and trans-3-indan-5-ylprop-2-enoic acid, by the method of Example 1, step K, giving a solid that was mostly the more polar cyclohexyl diastereomer by LCMS. Mass spectrum (LCMS, ESI pos.) calcd. for C33H40N4O2: 525 (M+H). Found: 525

WORKUP

后处理

customgiving a solid

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-13c60e2ef089402db30b1d65fd5236a3
来源数据集: uspto-grants-2014_12
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08921559B2
来源说明: uspto-grants-2014_12

反应 SMILES

Cl.Cl.[NH:3]1[C:11]2[C:6](=[CH:7][CH:8]=[CH:9][CH:10]=2)[C:5]([CH:12]2[CH2:17][CH2:16][CH:15]([NH:18][CH:19]([CH:23]3[CH2:28][CH2:27][NH:26][CH2:25][CH2:24]3)[C:20]([NH2:22])=[O:21])[CH2:14][CH2:13]2)=[CH:4]1.[CH2:29]1[C:37]2[C:32](=[CH:33][C:34](/[CH:38]=[CH:39]/[C:40](O)=[O:41])=[CH:35][CH:36]=2)[CH2:31][CH2:30]1>>[NH:3]1[C:11]2[C:6](=[CH:7][CH:8]=[CH:9][CH:10]=2)[C:5]([CH:12]2[CH2:17][CH2:16][CH:15]([NH:18][CH:19]([CH:23]3[CH2:24][CH2:25][N:26]([C:40](=[O:41])/[CH:39]=[CH:38]/[C:34]4[CH:33]=[C:32]5[C:37](=[CH:36][CH:35]=4)[CH2:29][CH2:30][CH2:31]5)[CH2:27][CH2:28]3)[C:20]([NH2:22])=[O:21])[CH2:14][CH2:13]2)=[CH:4]1