HRID1066332

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

结构：O=C(Cc1cccnc1)N1CCC(=C2c3ccc(Cl)cc3CCc3c(Cl)ccnc32)CC1

HCID22621955

未命名化合物

HCID178482029

未命名化合物

PRODUCTS

生成物

结构：Cn1nnc(Sc2ccnc3c2CCc2cc(Cl)ccc2C3=C2CCN(C(=O)Cc3cccnc3)CC2)n1

HCID22621956

未命名化合物

收率 68%

PROCEDURE

实验过程

A mixture of the title compound from Example 250 (0.24 grams), 5-mercapto-1-methyltetrazole sodium salt (0.6 grams) and anhydrous DMF (10 mL) was stirred while being irradiated with a 200 W lamp for 10 days. Isolation and purification as in Example 257 provided the title compound (0.2 grams, 68%, MH+ 544).

WORKUP

后处理

customwhile being irradiated with a 200 W lamp for 10 days
customIsolation and purification as in Example 257

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ff127824856b4ba48e7fbaaab5968553
来源数据集: uspto-grants-2001_06
DOI: 10.6084/m9.figshare.5104873.v1
专利: US06242458B1
来源说明: uspto-grants-2001_06

反应 SMILES

Cl[C:2]1[CH:7]=[CH:6][N:5]=[C:4]2[C:8](=[C:18]3[CH2:23][CH2:22][N:21]([C:24](=[O:32])[CH2:25][C:26]4[CH:27]=[N:28][CH:29]=[CH:30][CH:31]=4)[CH2:20][CH2:19]3)[C:9]3[CH:16]=[CH:15][C:14]([Cl:17])=[CH:13][C:10]=3[CH2:11][CH2:12][C:3]=12.[Na].[SH:34][C:35]1[N:39](C)[N:38]=[N:37][N:36]=1.[CH3:41]N(C=O)C>>[Cl:17][C:14]1[CH:15]=[CH:16][C:9]2[C:8](=[C:18]3[CH2:23][CH2:22][N:21]([C:24](=[O:32])[CH2:25][C:26]4[CH:27]=[N:28][CH:29]=[CH:30][CH:31]=4)[CH2:20][CH2:19]3)[C:4]3=[N:5][CH:6]=[CH:7][C:2]([S:34][C:35]4[N:39]=[N:38][N:37]([CH3:41])[N:36]=4)=[C:3]3[CH2:12][CH2:11][C:10]=2[CH:13]=1