HRID443478

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID13347

未命名化合物

HCID24386

Thionyl chloride

Cl2OS

HCID11949691

未命名化合物

PRODUCTS

生成物

结构：N=C(N)NCC1Cc2ccccc2N1.N=C(N)NCC1Cc2ccccc2N1.O=S(=O)(O)O

HCID178512743

未命名化合物

AUXILIARIES

试剂、催化剂与溶剂

催化剂HCID23938

Palladium

溶剂HCID702

Ethanol

C2H6O

PROCEDURE

实验过程

10 g of 1-benzyl-2-guanidinomethyl-indoline hemisulphate (obtainable from ethyl indoline-2-carboxylate by N-benzylation, reduction and reaction with SOCl2 to give 1-benzyl-2-chloromethyl-indoline, reaction of the latter with potassium phthalimide and hydrolysis of the reaction product, and reaction of this product with S-methyl-isothiourea hemisulphate) are dissolved in 200 ml of ethanol and hydrogenated over 3 g of 5% Pd/C at 20° C. and 1 atmosphere until the reaction ceases. After filtering and evaporating the filtrate, 2-guanidinomethyl-indoline hemisulphate is obtained.

WORKUP

后处理

customto give
custom1 atmosphere until the reaction ceases
filtrationAfter filtering
customevaporating the filtrate

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-fba2e1b2f2a44d9c9008b938e3f3152c
来源数据集: uspto-grants-1981_04
DOI: 10.6084/m9.figshare.5104873.v1
专利: US04260628
来源说明: uspto-grants-1981_04

反应 SMILES

[S:1]([OH:5])([OH:4])(=[O:3])=[O:2].C([N:13]1[C:21]2[C:16](=[CH:17][CH:18]=[CH:19][CH:20]=2)[CH2:15][CH:14]1[CH2:22][NH:23][C:24]([NH2:26])=[NH:25])C1C=CC=CC=1.C(N1C2C(=CC=CC=2)CC1CNC(N)=N)C1C=CC=CC=1.N1C2C(=CC=CC=2)CC1C(OCC)=O.O=S(Cl)Cl.C(N1C2C(=CC=CC=2)CC1CCl)C1C=CC=CC=1.C1(=O)NC(=O)C2=CC=CC=C12.[K].S(O)(O)(=O)=O.CSC(=N)N.CSC(=N)N>C(O)C.[Pd]>[S:1]([OH:5])([OH:4])(=[O:3])=[O:2].[NH:23]([CH2:22][CH:14]1[CH2:15][C:16]2[C:21](=[CH:20][CH:19]=[CH:18][CH:17]=2)[NH:13]1)[C:24]([NH2:26])=[NH:25].[NH:23]([CH2:22][CH:14]1[CH2:15][C:16]2[C:21](=[CH:20][CH:19]=[CH:18][CH:17]=2)[NH:13]1)[C:24]([NH2:26])=[NH:25]