HRID2373742

反应详情

EQUATION

反应方程式

REACTANTS

反应物

反应SMILES：CC(C)(C)c1cc(C(=O)Nc2ccc(N)cc2)cc(C(C)(C)C)c1O

HCID15389740

未命名化合物

反应SMILES：COc1ccc2[nH]cc(CC(=O)N3CCN(c4ccc(N)cc4)CC3)c2c1

HCID22987726

未命名化合物

反应SMILES：CC(C)(C)c1cc(C(=O)Nc2ccc(NC(=N)c3cccs3)cc2)cc(C(C)(C)C)c1O.Cl

HCID178441077

未命名化合物

PRODUCTS

产物

反应SMILES：COc1ccc2[nH]cc(CC(=O)N3CCN(c4ccc(NC(=N)c5cccs5)cc4)CC3)c2c1

HCID178488077

未命名化合物

收率 20%

PROCEDURE

实验过程

The experimental protocol used is the same as that described for the compound 1, with 1-[(5 methoxy-1H-indole-3-yl)methylcarbonyl]-4-(4-aminophenyl)-piperazine replacing the 3,5-bis-(1,1-dimethylethyl)-4-hydroxy-N-(4-aminophenyl)-benzamide. The expected product is isolated in the form of the free base with a yield of 20% (pale yellow powder). Melting point: 221-222° C.

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-cef512822fb041ce853564292b736885
来源数据集: uspto-grants-2008_12
DOI: 10.6084/m9.figshare.5104873.v1
专利号: US07459558B2
来源说明: uspto-grants-2008_12

反应SMILES

Cl.CC(C1C=[C:8](C=C(C(C)(C)C)C=1O)[C:9]([NH:11][C:12]1[CH:17]=[CH:16][C:15]([NH:18][C:19]([C:21]2[S:22][CH:23]=[CH:24][CH:25]=2)=[NH:20])=[CH:14][CH:13]=1)=O)(C)C.[CH3:34][O:35][C:36]1[CH:37]=[C:38]2[C:42](=[CH:43][CH:44]=1)[NH:41][CH:40]=[C:39]2[CH2:45][C:46]([N:48]1CCN(C2C=CC(N)=CC=2)[CH2:50][CH2:49]1)=[O:47].CC(C1C=C(C=C(C(C)(C)C)C=1O)C(NC1C=CC(N)=CC=1)=O)(C)C>>[CH3:34][O:35][C:36]1[CH:37]=[C:38]2[C:42](=[CH:43][CH:44]=1)[NH:41][CH:40]=[C:39]2[CH2:45][C:46]([N:48]1[CH2:8][CH2:9][N:11]([C:12]2[CH:13]=[CH:14][C:15]([NH:18][C:19]([C:21]3[S:22][CH:23]=[CH:24][CH:25]=3)=[NH:20])=[CH:16][CH:17]=2)[CH2:50][CH2:49]1)=[O:47]