HRID271430

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6328

Methyl iodide

CH3I

结构：CCNC1(C(N)=O)CN(c2nc(-c3ccc(Cl)cc3)c(-c3ccc(Cl)cc3)c3nn(CC)c(=O)n23)C1

HCID15953098

未命名化合物

结构：CCNC1(C(N)=O)CN(c2nc(-c3ccc(Cl)cc3)c(-c3ccc(Cl)cc3)c3n[nH]c(=O)n23)C1

HCID58772845

未命名化合物

PRODUCTS

生成物

结构：CCNC1(C(N)=O)CN(c2nc(-c3ccc(Cl)cc3)c(-c3ccc(Cl)cc3)c3nn(C)c(=O)n23)C1

HCID15953099

未命名化合物

PROCEDURE

实验过程

The title compound was prepared by coupling 1-(7,8-bis(4-chlorophenyl)-3-oxo-2,3-dihydro-[1,2,4]triazolo[4,3-c]pyrimidin-5-yl)-3-(ethylamino)azetidine-3-carboxamide with iodomethane in a manner analogous to that in which 1-(7,8-bis(4-chlorophenyl)-2-ethyl-3-oxo-2,3-dihydro-[1,2,4]triazolo[4,3-c]pyrimidin-5-yl)-3-(ethylamino)azetidine-3-carboxamide was prepared. HPLC/MS: retention time 3.318 min, [M+H]30 =512.

WORKUP

后处理

customwas prepared

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8a9507c134da4a0fb43f64df1ae2bc19
来源数据集: uspto-grants-2008_11
DOI: 10.6084/m9.figshare.5104873.v1
专利: US07452892B2
来源说明: uspto-grants-2008_11

反应 SMILES

ClC1C=CC(C2N=C(N3CC(NCC)(C(N)=O)C3)N3C(=O)NN=C3C=2C2C=CC(Cl)=CC=2)=CC=1.IC.[Cl:37][C:38]1[CH:43]=[CH:42][C:41]([C:44]2[N:49]=[C:48]([N:50]3[CH2:53][C:52]([NH:57][CH2:58][CH3:59])([C:54]([NH2:56])=[O:55])[CH2:51]3)[N:47]3[C:60](=[O:65])[N:61]([CH2:63]C)[N:62]=[C:46]3[C:45]=2[C:66]2[CH:71]=[CH:70][C:69]([Cl:72])=[CH:68][CH:67]=2)=[CH:40][CH:39]=1>>[Cl:37][C:38]1[CH:39]=[CH:40][C:41]([C:44]2[N:49]=[C:48]([N:50]3[CH2:53][C:52]([NH:57][CH2:58][CH3:59])([C:54]([NH2:56])=[O:55])[CH2:51]3)[N:47]3[C:60](=[O:65])[N:61]([CH3:63])[N:62]=[C:46]3[C:45]=2[C:66]2[CH:67]=[CH:68][C:69]([Cl:72])=[CH:70][CH:71]=2)=[CH:42][CH:43]=1