HRID2260641

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID517766

5-Isocyanato-1,2,3-trimethoxybenzene

C10H11NO4

结构：Cn1nc(C2CCN(CC(O)c3ccccc3)CC2)c2ccc(F)cc21

HCID18998823

未命名化合物

PRODUCTS

生成物

结构：COc1cc(NC(=O)OC(CN2CCC(c3nn(C)c4cc(F)ccc34)CC2)c2ccccc2)cc(OC)c1OC

HCID18998795

未命名化合物

收率 34%

PROCEDURE

实验过程

Starting from 1-(2-hydroxy-2-phenyl-ethyl)-4-(6-fluoro-1-methyl-1H -indazol-3-yl)-piperidine (300 mg; 0.85 mmol) and 3,4,5-trimethoxyphenylisocyanate (300 mg; 1.44 mmol) using the procedure described in example 8B was prepared 160 mg (34%) of the title compound.

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-27a9e270c7bb43b3adf64f9a675c8aef
来源数据集: uspto-grants-1995_12
DOI: 10.6084/m9.figshare.5104873.v1
专利: US05478845
来源说明: uspto-grants-1995_12

反应 SMILES

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