HRID1445952

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

结构：CCC(COC(=O)c1cc(OC)c(OC)c(OC)c1)(c1ccccc1)N(C)C

HCID5573

Trimebutine

C22H29NO5

HCID16772501

4-Carbamothioylbenzoic acid

C8H7NO2S

PRODUCTS

生成物

结构：CCC(COC(=O)c1cc(OC)c(OC)c(OC)c1)(c1ccccc1)N(C)C.NC(=S)c1ccc(C(=O)O)cc1

HCID86616553

未命名化合物

AUXILIARIES

试剂、催化剂与溶剂

溶剂HCID702

Ethanol

C2H6O

PROCEDURE

实验过程

To a mixture of 4-(thiocarbamoyl) benzoic acid (0.1 mol) and trimebutine (0.1 mol), water (200 mL) and ethyl alcohol (20 mL) have been added and the resulting suspension has been stirred at room temperature until clear. Then the solution has been frozen and lyophilized furnishing the desired salt (quantitative yield).

WORKUP

后处理

additionhave been added
temperatureThen the solution has been frozen

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c7e76be668bf4ee98a125baaef6d4816
来源数据集: uspto-grants-2010_02
DOI: 10.6084/m9.figshare.5104873.v1
专利: US07666907B2
来源说明: uspto-grants-2010_02

反应 SMILES

[C:1]([C:4]1[CH:12]=[CH:11][C:7]([C:8]([OH:10])=[O:9])=[CH:6][CH:5]=1)(=[S:3])[NH2:2].[CH3:13][CH2:14][C:15]([N:38]([CH3:40])[CH3:39])([C:32]1[CH:33]=[CH:34][CH:35]=[CH:36][CH:37]=1)[CH2:16][O:17][C:18]([C:20]1[CH:21]=[C:22]([O:30][CH3:31])[C:23]([O:28][CH3:29])=[C:24]([O:26][CH3:27])[CH:25]=1)=[O:19].O>C(O)C>[C:1]([C:4]1[CH:12]=[CH:11][C:7]([C:8]([OH:10])=[O:9])=[CH:6][CH:5]=1)(=[S:3])[NH2:2].[CH3:40][N:38]([CH3:39])[C:15]([C:32]1[CH:37]=[CH:36][CH:35]=[CH:34][CH:33]=1)([CH2:14][CH3:13])[CH2:16][O:17][C:18](=[O:19])[C:20]1[CH:25]=[C:24]([O:26][CH3:27])[C:23]([O:28][CH3:29])=[C:22]([O:30][CH3:31])[CH:21]=1