HRID816263

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID887

Methanol

CH4O

HCID31275

1,4-Dioxane

C4H8O2

结构：CCC(C)(C)Cc1cn(C(c2ccccc2)(c2ccccc2)c2ccccc2)c(CC(NC(=O)OC)c2ccc(-c3ccc(F)cn3)cc2)n1

HCID86638502

未命名化合物

PRODUCTS

生成物

结构：CCC(C)(C)Cc1c[nH]c(CC(NC(=O)OC)c2ccc(-c3ccc(F)cn3)cc2)n1

HCID178442454

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-cac4bd7173e242a7b7fdae47db0a0a69
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[CH3:2][C:3]([CH2:4][c:5]1[n:6][c:7]([CH2:29][CH:30]([c:31]2[cH:32][cH:33][c:34](-[c:37]3[n:38][cH:39][c:40]([F:43])[cH:41][cH:42]3)[cH:35][cH:36]2)[NH:44][C:45]([O:46][CH3:47])=[O:48])[n:8]([C:10]([c:11]2[cH:12][cH:13][cH:14][cH:15][cH:16]2)([c:17]2[cH:18][cH:19][cH:20][cH:21][cH:22]2)[c:23]2[cH:24][cH:25][cH:26][cH:27][cH:28]2)[cH:9]1)([CH2:49][CH3:50])[CH3:51].[CH3:58][OH:59].[ClH:1].[O:52]1[CH2:53][CH2:54][O:55][CH2:56][CH2:57]1>>[CH3:2][C:3]([CH2:4][c:5]1[n:6][c:7]([CH2:29][CH:30]([c:31]2[cH:32][cH:33][c:34](-[c:37]3[n:38][cH:39][c:40]([F:43])[cH:41][cH:42]3)[cH:35][cH:36]2)[NH:44][C:45]([O:46][CH3:47])=[O:48])[nH:8][cH:9]1)([CH2:49][CH3:50])[CH3:51]