HRID396076

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：COc1c(C(=O)N2CCC(Nc3ccc(CCN)cc3)CC2)sc2ccccc12

HCID18174005

未命名化合物

HCID23381346

未命名化合物

PRODUCTS

生成物

结构：COc1c(C(=O)N2CCC(Nc3ccc(CCNC[C@H](O)COc4cccc(NC(C)=O)c4)cc3)CC2)sc2ccccc12

HCID69985859

未命名化合物

收率 23.4%

PROCEDURE

实验过程

{4-[4-(2-Aminoethyl)anilino]-1-piperidinyl}(3-methoxy-1-benzothiophen-2-yl)methanone (0.170 g, 0.415 mmol) was reacted with N-{3-[(2S)oxiranylmethoxy]phenyl}acetamide (0.086 g, 0.415 mmol) according to Procedure G to give the title compound (0.06 g, 0.097 mmol).

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5f82b695ddd847039efedaf2799a3e78
来源数据集: uspto-grants-2003_08
DOI: 10.6084/m9.figshare.5104873.v1
专利: US06605618B2
来源说明: uspto-grants-2003_08

反应 SMILES

[NH2:1][CH2:2][CH2:3][C:4]1[CH:29]=[CH:28][C:7]([NH:8][CH:9]2[CH2:14][CH2:13][N:12]([C:15]([C:17]3[S:18][C:19]4[CH:27]=[CH:26][CH:25]=[CH:24][C:20]=4[C:21]=3[O:22][CH3:23])=[O:16])[CH2:11][CH2:10]2)=[CH:6][CH:5]=1.[O:30]1[CH2:32][C@H:31]1[CH2:33][O:34][C:35]1[CH:36]=[C:37]([NH:41][C:42](=[O:44])[CH3:43])[CH:38]=[CH:39][CH:40]=1>>[OH:30][C@@H:31]([CH2:32][NH:1][CH2:2][CH2:3][C:4]1[CH:5]=[CH:6][C:7]([NH:8][CH:9]2[CH2:10][CH2:11][N:12]([C:15]([C:17]3[S:18][C:19]4[CH:27]=[CH:26][CH:25]=[CH:24][C:20]=4[C:21]=3[O:22][CH3:23])=[O:16])[CH2:13][CH2:14]2)=[CH:28][CH:29]=1)[CH2:33][O:34][C:35]1[CH:36]=[C:37]([NH:41][C:42](=[O:44])[CH3:43])[CH:38]=[CH:39][CH:40]=1