HRID110074

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8471

Triethylamine

C6H15N

HCID67561

alpha,alpha,alpha-Trifluoro-o-toluoyl chloride

C8H4ClF3O

结构：Nc1ccc(C(=O)N2Cc3ccccc3Cc3ccccc32)cc1

HCID15410467

未命名化合物

PRODUCTS

生成物

结构：O=C(Nc1ccc(C(=O)N2Cc3ccccc3Cc3ccccc32)cc1)c1ccccc1C(F)(F)F

HCID67625470

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-cfd72b31ec284c3e86aed2321576a66d
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

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