HRID103654

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

2 次

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

HCID15908

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

C8H17N3

HCID74280

Indole-5-carboxylic acid

C9H7NO2

HCID2777115

4-(4-Chlorobenzoyl)Piperidine

C12H14ClNO

PRODUCTS

生成物

结构：O=C(c1ccc(Cl)cc1)C1CCN(C(=O)c2ccc3[nH]ccc3c2)CC1

HCID9947354

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ccfdd0c35ab345899f752a2224299716
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

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