HRID2333354

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID65578

Ethanedioyl dichloride

C2Cl2O2

HCID2776438

2-Phenyl-5-(trifluoromethyl)oxazole-4-carboxylic acid

C11H6F3NO3

HCID21940085

tert-Butyl 4-(4-aminophenyl)piperidine-1-carboxylate

C16H24N2O2

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1CCC(c2ccc(NC(=O)c3nc(-c4ccccc4)oc3C(F)(F)F)cc2)CC1

HCID66738365

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b59c1bc2eb3949e39f0198c05a2d0fcd
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

[C:25]([CH3:26])([CH3:27])([CH3:28])[O:29][C:30](=[O:31])[N:32]1[CH2:33][CH2:34][CH:35]([c:38]2[cH:39][cH:40][c:41]([NH2:44])[cH:42][cH:43]2)[CH2:36][CH2:37]1.[CH2:52]([Cl:53])[Cl:54].[CH3:45][CH2:46][N:47]([CH2:48][CH3:49])[CH2:50][CH3:51].[Cl:19][C:20]([C:21]([Cl:22])=[O:23])=[O:24].[O:55]=[CH:56][N:57]([CH3:58])[CH3:59].[c:1]1(-[c:7]2[o:8][c:9]([C:15]([F:16])([F:17])[F:18])[c:10]([C:12](=[O:13])[OH:14])[n:11]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1(-[c:7]2[o:8][c:9]([C:15]([F:16])([F:17])[F:18])[c:10]([C:12](=[O:14])[NH:44][c:41]3[cH:40][cH:39][c:38]([CH:35]4[CH2:34][CH2:33][N:32]([C:30]([O:29][C:25]([CH3:26])([CH3:27])[CH3:28])=[O:31])[CH2:37][CH2:36]4)[cH:43][cH:42]3)[n:11]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1