HRID2213157

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6422

未命名化合物

HCID21955411

未命名化合物

结构：CC(C)(C)OC(=O)CC1c2ccccc2C(=O)N(CC(=O)[O-])c2ccccc21

HCID21955461

未命名化合物

PRODUCTS

生成物

结构：CC(=O)OC1c2ccccc2C(=O)N(CC(=O)NCc2cccc(NC(=O)NCc3ccccc3)c2)c2ccccc21

HCID21955513

未命名化合物

AUXILIARIES

试剂、催化剂与溶剂

溶剂HCID22277986

未命名化合物

PROCEDURE

实验过程

Coupling of 11-(2-tert-butoxy-2-oxoethyl)-6-oxo-6,11-dihydro-5H-dibenzo[b,e]azepin-5-yl acetate (66) with (3-{[(benzylamino)-carbonyl]amino}phenyl)methanamine (hydrochloride) (41), TFA cleavage and stirring of the resulting crude product with methyl tert-butyl ether/CH3OH 19:1 afforded 0.61 g of slightly brownish solids; ESI-MS [M+H+]=563.25.

WORKUP

后处理

customafforded 0.61 g of slightly brownish solids

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1bce2b55572f4327be5a30c3f8323560
来源数据集: uspto-grants-2006_09
DOI: 10.6084/m9.figshare.5104873.v1
专利: US07105508B1
来源说明: uspto-grants-2006_09

反应 SMILES

C(OC(=O)C[CH:8]1[C:14]2[CH:15]=[CH:16][CH:17]=[CH:18][C:13]=2[C:12](=[O:19])[N:11]([CH2:20][C:21]([O-])=[O:22])[C:10]2[CH:24]=[CH:25][CH:26]=[CH:27][C:9]1=2)(C)(C)C.[NH2:29][CH2:30][C:31]1[CH:32]=[C:33]([NH:37][C:38]([NH:40][CH2:41][C:42]2[CH:47]=[CH:46][CH:45]=[CH:44][CH:43]=2)=[O:39])[CH:34]=[CH:35][CH:36]=1.[C:48]([OH:54])([C:50](F)(F)F)=[O:49]>C(OC)(C)(C)C.CO>[C:48]([O:54][CH:8]1[C:14]2[CH:15]=[CH:16][CH:17]=[CH:18][C:13]=2[C:12](=[O:19])[N:11]([CH2:20][C:21]([NH:29][CH2:30][C:31]2[CH:36]=[CH:35][CH:34]=[C:33]([NH:37][C:38]([NH:40][CH2:41][C:42]3[CH:43]=[CH:44][CH:45]=[CH:46][CH:47]=3)=[O:39])[CH:32]=2)=[O:22])[C:10]2[CH:24]=[CH:25][CH:26]=[CH:27][C:9]1=2)(=[O:49])[CH3:50]