HRID704127

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：COc1ccc(CCNC(=O)CNc2cccc(C(N)=O)c2)cc1OC

HCID156651

3-[[2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxoethyl]amino]benzamide

C19H23N3O4

结构：O=S(=O)([O-])CO.O=S(=O)([O-])CO.[Ca+2]

HCID88512835

未命名化合物

PRODUCTS

生成物

HCID5460341

Calcium

结构：COc1ccc(CCNC(=O)CN(CS(=O)(=O)O)c2cccc(C(N)=O)c2)cc1OC.COc1ccc(CCNC(=O)CN(CS(=O)(=O)O)c2cccc(C(N)=O)c2)cc1OC.O

HCID131716758

未命名化合物

PROCEDURE

实验过程

2-(3-Carbamoylphenylamino)-N-(3,4-dimethoxyphenethyl)acetamide (hereinafter referred to Compound A) was reacted with calcium hydroxymethanesulfonate in the same manner as described in Example 16 to give calcium bis(N-(3-carbamoylphenyl)-N-(2-((2-(3,4-dimethoxyphenyl)ethyl)amino)-2-oxoethyl)aminomethanesulfonate hemihydrate as colorless crystals with m.p. 265° to 267° C. (decomposition).

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4ae8dfe5af5742eb9f8c8f7d953c24ee
来源数据集: uspto-grants-1991_01
DOI: 10.6084/m9.figshare.5104873.v1
专利: US04985595
来源说明: uspto-grants-1991_01

反应 SMILES

[C:1]([C:4]1[CH:5]=[C:6]([NH:10][CH2:11][C:12]([NH:14][CH2:15][CH2:16][C:17]2[CH:22]=[CH:21][C:20]([O:23][CH3:24])=[C:19]([O:25][CH3:26])[CH:18]=2)=[O:13])[CH:7]=[CH:8][CH:9]=1)(=[O:3])[NH2:2].O[CH2:28][S:29]([O-:32])(=[O:31])=[O:30].[Ca+2:33].O[CH2:35][S:36]([O-:39])(=[O:38])=[O:37]>>[Ca:33].[OH2:3].[C:1]([C:4]1[CH:5]=[C:6]([N:10]([CH2:28][S:29]([OH:32])(=[O:31])=[O:30])[CH2:11][C:12]([NH:14][CH2:15][CH2:16][C:17]2[CH:22]=[CH:21][C:20]([O:23][CH3:24])=[C:19]([O:25][CH3:26])[CH:18]=2)=[O:13])[CH:7]=[CH:8][CH:9]=1)(=[O:3])[NH2:2].[C:1]([C:4]1[CH:5]=[C:6]([N:10]([CH2:35][S:36]([OH:39])(=[O:38])=[O:37])[CH2:11][C:12](=[O:13])[NH:14][CH2:15][CH2:16][C:17]2[CH:22]=[CH:21][C:20]([O:23][CH3:24])=[C:19]([O:25][CH3:26])[CH:18]=2)[CH:7]=[CH:8][CH:9]=1)(=[O:3])[NH2:2]