HRID94957

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6342

Acetonitrile

C2H3N

HCID6344

Dichloromethane

CH2Cl2

HCID7914

Isopropyl ether

C6H14O

HCID8471

Triethylamine

C6H15N

HCID67695

[3-(Trifluoromethyl)phenyl]acetic acid

C9H7F3O2

HCID21264544

未命名化合物

PRODUCTS

产物

HCID67915869

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-ce8edca747b349f29c27eee0c42a89ba
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].[CH3:55][C:56]#[N:57].[CH:45]([O:46][CH:47]([CH3:48])[CH3:49])([CH3:50])[CH3:51].[Cl:52][CH2:53][Cl:54].[ClH:15].[F:1][C:2]([c:3]1[cH:4][c:5]([CH2:9][C:10](=[O:11])[OH:12])[cH:6][cH:7][cH:8]1)([F:13])[F:14].[c:16]1([C:22]2([c:32]3[cH:33][cH:34][cH:35][cH:36][cH:37]3)[CH2:23][CH2:24][C:25](=[O:31])[CH:26]3[CH2:27][NH:28][CH2:29][CH:30]23)[cH:17][cH:18][cH:19][cH:20][cH:21]1>>[F:1][C:2]([c:3]1[cH:4][c:5]([CH2:9][C:10](=[O:12])[N:28]2[CH2:27][CH:26]3[C:25](=[O:31])[CH2:24][CH2:23][C:22]([c:16]4[cH:17][cH:18][cH:19][cH:20][cH:21]4)([c:32]4[cH:33][cH:34][cH:35][cH:36][cH:37]4)[CH:30]3[CH2:29]2)[cH:6][cH:7][cH:8]1)([F:13])[F:14]