HRID118859

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6344

Dichloromethane

CH2Cl2

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

HCID15908

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

C8H17N3

HCID66724

[1,1'-Biphenyl]-4-carboxylic acid

C13H10O2

HCID70766

Isoquinol-5-ylamine

C9H8N2

PRODUCTS

生成物

HCID313

Hydrochloric Acid

ClH

结构：O=C(Nc1cccc2cnccc12)c1ccc(-c2ccccc2)cc1

HCID29371818

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-0f0d67049ac547878a134a6bbb16db0c
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

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