HRID2202444

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6395

Methanesulfonic acid

CH4O3S

结构：Cc1cc2c(cc1N1CCC(N3CCOCC3)CC1)C(C)(C)c1[nH]c3cc(C#N)ccc3c1C2=O

HCID49806722

未命名化合物

PRODUCTS

生成物

结构：CS(=O)(=O)O.Cc1cc2c(cc1N1CCC(N3CCOCC3)CC1)C(C)(C)c1[nH]c3cc(C#N)ccc3c1C2=O

HCID86686435

未命名化合物

AUXILIARIES

试剂、催化剂与溶剂

溶剂HCID679

Dimethyl sulfoxide

C2H6OS

PROCEDURE

实验过程

6,6,9-Trimethyl-8-(4-morpholin-4-yl-piperidin-1-yl)-11-oxo-6,11-dihydro-5H-benzo[b]carbazole-3-carbonitrile was added with 1.05 eq. of 2 N methane sulfonic acid and DMSO and dissolved therein. After freeze-drying, the mixture was crystallized from ethanol to give 6,6,9-trimethyl-8-(4-morpholin-4-yl-piperidin-1-yl)-11-oxo-6,11-dihydro-5H-benzo[b]carbazole-3-carbonitrile methane sulfonic acid salt.

WORKUP

后处理

dissolutiondissolved
customAfter freeze-drying
customthe mixture was crystallized from ethanol

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5169746126aa4c22ad9eb3bc1e034547
来源数据集: uspto-grants-2016_06
DOI: 10.6084/m9.figshare.5104873.v1
专利: US09365514B2
来源说明: uspto-grants-2016_06

反应 SMILES

[CH3:1][C:2]1([CH3:35])[C:14]2[NH:13][C:12]3[C:7](=[CH:8][CH:9]=[C:10]([C:15]#[N:16])[CH:11]=3)[C:6]=2[C:5](=[O:17])[C:4]2[CH:18]=[C:19]([CH3:34])[C:20]([N:22]3[CH2:27][CH2:26][CH:25]([N:28]4[CH2:33][CH2:32][O:31][CH2:30][CH2:29]4)[CH2:24][CH2:23]3)=[CH:21][C:3]1=2.[CH3:36][S:37]([OH:40])(=[O:39])=[O:38]>CS(C)=O>[CH3:36][S:37]([OH:40])(=[O:39])=[O:38].[CH3:1][C:2]1([CH3:35])[C:14]2[NH:13][C:12]3[C:7](=[CH:8][CH:9]=[C:10]([C:15]#[N:16])[CH:11]=3)[C:6]=2[C:5](=[O:17])[C:4]2[CH:18]=[C:19]([CH3:34])[C:20]([N:22]3[CH2:23][CH2:24][CH:25]([N:28]4[CH2:29][CH2:30][O:31][CH2:32][CH2:33]4)[CH2:26][CH2:27]3)=[CH:21][C:3]1=2