HRID2043932

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID43453307

N-(Cyclopentylmethyl)-4-(methanesulfonyl)aniline

C13H19NO2S

HCID57481427

Ethyl 2-[(2-amino-1,3-thiazol-5-yl)sulfanyl]-2-methylpropanoate

C9H14N2O2S2

结构：CS(=O)(=O)c1ccc(N(CC2CCCC2)C(=O)Nc2nc(CC(=O)O)cs2)cc1

HCID57668194

未命名化合物

结构：CCOC(=O)C(C)(C)Sc1cnc(NC(=O)N(CC2CCCC2)c2ccc(S(C)(=O)=O)cc2)s1

HCID86629882

未命名化合物

PRODUCTS

生成物

结构：CC(C)(Sc1cnc(NC(=O)N(CC2CCCC2)c2ccc(S(C)(=O)=O)cc2)s1)C(=O)O

HCID57668336

未命名化合物

PROCEDURE

实验过程

The title compound was prepared via 2-{2-[3-cyclopentylmethyl-3-(4-methanesulfonylphenyl)-ureido]-thiazol-5-ylsulfanyl}-2-methyl-propionic acid ethyl ester in a similar manner as described for the synthesis of {2-[3-cyclopentylmethyl-3-(4-methanesulfonyl-phenyl)-ureido]-thiazol-4-yl}-acetic acid, using cyclopentylmethyl-(4-methanesulfonyl-phenyl)-amine and 2-(2-amino-thiazol-5-ylsulfanyl)-2-methyl-propionic acid ethyl ester.

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-0a1eb419fac24c0885ac286553479a6f
来源数据集: uspto-grants-2013_11
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08586614B2
来源说明: uspto-grants-2013_11

反应 SMILES

C([O:3][C:4](=[O:34])[C:5]([S:8][C:9]1[S:13][C:12]([NH:14][C:15]([N:17]([CH2:28][CH:29]2[CH2:33][CH2:32][CH2:31][CH2:30]2)[C:18]2[CH:23]=[CH:22][C:21]([S:24]([CH3:27])(=[O:26])=[O:25])=[CH:20][CH:19]=2)=[O:16])=[N:11][CH:10]=1)([CH3:7])[CH3:6])C.C1(CN(C2C=CC(S(C)(=O)=O)=CC=2)C(=O)NC2SC=C(CC(O)=O)N=2)CCCC1.C1(CNC2C=CC(S(C)(=O)=O)=CC=2)CCCC1.C(OC(=O)C(SC1SC(N)=NC=1)(C)C)C>>[CH:29]1([CH2:28][N:17]([C:18]2[CH:23]=[CH:22][C:21]([S:24]([CH3:27])(=[O:25])=[O:26])=[CH:20][CH:19]=2)[C:15](=[O:16])[NH:14][C:12]2[S:13][C:9]([S:8][C:5]([CH3:7])([CH3:6])[C:4]([OH:34])=[O:3])=[CH:10][N:11]=2)[CH2:33][CH2:32][CH2:31][CH2:30]1