HRID36303

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID69018

Propionyl bromide

C3H5BrO

HCID81184

1,8-Diazabicyclo[5.4.0]undec-7-ene

C9H16N2

结构：CCCCc1nn(-c2cc(N)ccc2C(F)(F)F)c(=O)n1Cc1ccc(-c2ccccc2S(=O)(=O)NC(=O)c2ccccc2Cl)cc1F

HCID19939446

未命名化合物

PRODUCTS

生成物

结构：CCCCc1nn(-c2cc(NC(=O)CC)ccc2C(F)(F)F)c(=O)n1Cc1ccc(-c2ccccc2S(=O)(=O)NC(=O)c2ccccc2Cl)cc1F

HCID10395335

未命名化合物

收率 60%

AUXILIARIES

试剂、催化剂与溶剂

溶剂HCID21226129

未命名化合物

PROCEDURE

实验过程

The title compound was synthesized by reaction of 2-[5-amino-2-(trifluoromethyl)phenyl]-5-n-butyl-4-[[2'-[N-(2-chlorobenzoyl)sulfamoyl]-3-fluorobiphenyl-4-yl]methyl]-2,4-dihydro-3H-1,2,4-triazol-3-one (from Step G) with propionyl bromide (3 equivalents) and DBU (1.1 equiv) according to the method of Example 69. The material was obtained in 60% yield as a pale yellow solid, mp 181°-183° C.; homogeneous by TLC in 9:1 CH2Cl2 -MeOH; mass spectrum (FAB) m/e 796 (M+K)+.

WORKUP

后处理

customThe material was obtained in 60% yield as a pale yellow solid, mp 181°-183° C.

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-28b94c3178b9471c9dca3e858d554c9e
来源数据集: uspto-grants-1995_05
DOI: 10.6084/m9.figshare.5104873.v1
专利: US05411980
来源说明: uspto-grants-1995_05

反应 SMILES

[NH2:1][C:2]1[CH:3]=[CH:4][C:5]([C:45]([F:48])([F:47])[F:46])=[C:6]([N:8]2[C:12](=[O:13])[N:11]([CH2:14][C:15]3[CH:20]=[CH:19][C:18]([C:21]4[CH:26]=[CH:25][CH:24]=[CH:23][C:22]=4[S:27](=[O:39])(=[O:38])[NH:28][C:29](=[O:37])[C:30]4[CH:35]=[CH:34][CH:33]=[CH:32][C:31]=4[Cl:36])=[CH:17][C:16]=3[F:40])[C:10]([CH2:41][CH2:42][CH2:43][CH3:44])=[N:9]2)[CH:7]=1.[C:49](Br)(=[O:52])[CH2:50][CH3:51].C1CCN2C(=NCCC2)CC1>C(Cl)Cl.CO>[CH2:41]([C:10]1[N:11]([CH2:14][C:15]2[CH:20]=[CH:19][C:18]([C:21]3[CH:26]=[CH:25][CH:24]=[CH:23][C:22]=3[S:27](=[O:38])(=[O:39])[NH:28][C:29](=[O:37])[C:30]3[CH:35]=[CH:34][CH:33]=[CH:32][C:31]=3[Cl:36])=[CH:17][C:16]=2[F:40])[C:12](=[O:13])[N:8]([C:6]2[CH:7]=[C:2]([NH:1][C:49](=[O:52])[CH2:50][CH3:51])[CH:3]=[CH:4][C:5]=2[C:45]([F:46])([F:47])[F:48])[N:9]=1)[CH2:42][CH2:43][CH3:44]