HRID1113088

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID15908

1-Ethyl-3-(3'-dimethylaminopropyl)carbodiimide

C8H17N3

HCID74939

3-[2-(Trifluoromethyl)phenyl]-2-propenoic acid

C10H7F3O2

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID81531

Diisopropylethylamine

C8H19N

HCID21584155

1-Methylspiro[indole-3,4'-piperidin]-2(1H)-one

C13H16N2O

PRODUCTS

生成物

结构：CN1C(=O)C2(CCN(C(=O)C=Cc3ccccc3C(F)(F)F)CC2)c2ccccc21

HCID67224028

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b92cc238146845d39250c68bda8c4f0a
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

[CH3:1][N:2]1[C:3](=[O:16])[C:4]2([c:5]3[cH:6][cH:7][cH:8][cH:9][c:10]31)[CH2:11][CH2:12][NH:13][CH2:14][CH2:15]2.[CH3:42][CH2:43][N:44]=[C:45]=[N:46][CH2:47][CH2:48][CH2:49][N:50]([CH3:51])[CH3:52].[CH:53]([N:54]([CH2:55][CH3:56])[CH:57]([CH3:58])[CH3:59])([CH3:60])[CH3:61].[Cl:62][CH2:63][Cl:64].[F:17][C:18]([c:19]1[c:20]([CH:25]=[CH:26][C:27](=[O:28])[OH:29])[cH:21][cH:22][cH:23][cH:24]1)([F:30])[F:31].[OH:32][n:33]1[c:34]2[c:35]([cH:36][cH:37][cH:38][cH:39]2)[n:40][n:41]1>>[CH3:1][N:2]1[C:3](=[O:16])[C:4]2([c:5]3[cH:6][cH:7][cH:8][cH:9][c:10]31)[CH2:11][CH2:12][N:13]([C:27]([CH:26]=[CH:25][c:20]1[c:19]([C:18]([F:17])([F:30])[F:31])[cH:24][cH:23][cH:22][cH:21]1)=[O:28])[CH2:14][CH2:15]2