HRID723094

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID3939

Lithium hydroxide anhydrous

HLiO

HCID14798

Sodium Hydroxide

HNaO

结构：COC(=O)CC(=O)Nc1cccc(C)c1-c1cccc(S(=O)(=O)c2cc(C(=N)NC(=O)OC(C)(C)C)sc2SC)c1

HCID145857671

未命名化合物

PRODUCTS

生成物

结构：CSc1sc(C(=N)NC(=O)OC(C)(C)C)cc1S(=O)(=O)c1cccc(-c2c(C)cccc2NC(=O)CC(=O)O)c1

HCID145857639

未命名化合物

AUXILIARIES

试剂、催化剂与溶剂

溶剂HCID887

Methanol

CH4O

PROCEDURE

实验过程

N-{3′-[5-(tert-Butoxycarbonylamino-imino-methyl)-2-methylsulfanyl-thiophene-3-sulfonyl]-6-methyl-biphenyl-2-yl}-malonamic acid methyl ester (20 mg, 0.03 mmol, Example 132: step a) and NaOH (1M, 90 μL, 0.09 mmol) were dissolved into MeOH (1.5 mL). The reaction was stirred for 2 hours. LiOH (1.0 mg, 0.05 mmol) was added and the reaction was stirred at RT overnight. The solvents were removed in vacuo and used with out further purification in the next step. ESI-MS (m/z): Calcd. for C27H29N3O7S3: 604.1 (M+1); found: 504.0 (loss of boc).

WORKUP

后处理

stirringthe reaction was stirred at RT overnight
customThe solvents were removed in vacuo
customused with out further purification in the next step

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3cdd0db61f3140a9bec4f5c38c10c7a7
来源数据集: uspto-grants-2006_11
DOI: 10.6084/m9.figshare.5104873.v1
专利: US07138530B2
来源说明: uspto-grants-2006_11

反应 SMILES

C[O:2][C:3](=[O:41])[CH2:4][C:5]([NH:7][C:8]1[CH:13]=[CH:12][CH:11]=[C:10]([CH3:14])[C:9]=1[C:15]1[CH:20]=[CH:19][CH:18]=[C:17]([S:21]([C:24]2[CH:28]=[C:27]([C:29]([NH:31][C:32]([O:34][C:35]([CH3:38])([CH3:37])[CH3:36])=[O:33])=[NH:30])[S:26][C:25]=2[S:39][CH3:40])(=[O:23])=[O:22])[CH:16]=1)=[O:6].[OH-].[Na+].[Li+].[OH-]>CO>[C:35]([O:34][C:32]([NH:31][C:29](=[NH:30])[C:27]1[S:26][C:25]([S:39][CH3:40])=[C:24]([S:21]([C:17]2[CH:16]=[C:15]([C:9]3[C:10]([CH3:14])=[CH:11][CH:12]=[CH:13][C:8]=3[NH:7][C:5](=[O:6])[CH2:4][C:3]([OH:41])=[O:2])[CH:20]=[CH:19][CH:18]=2)(=[O:23])=[O:22])[CH:28]=1)=[O:33])([CH3:38])([CH3:36])[CH3:37]