HRID1544017

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID962

Water

H2O

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID15908

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

C8H17N3

HCID79222

6-Chloronicotinic acid

C6H4ClNO2

HCID409153

(1-aminocyclohexyl)methanol

C7H15NO

HCID178418300

未命名化合物

PRODUCTS

生成物

HCID11950360

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-de26d7eff3a84e81931a8112413b7c78
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

[CH3:1][CH2:2][N:3]([CH2:4][CH3:5])[CH2:6][CH3:7].[CH3:20][N:21]([CH3:22])[CH2:23][CH2:24][CH2:25][N:26]=[C:27]=[N:28][CH2:29][CH3:30].[Cl:31][c:32]1[n:33][cH:34][c:35]([C:36](=[O:37])[OH:38])[cH:39][cH:40]1.[Cl:50][CH2:51][Cl:52].[ClH:19].[NH2:41][C:42]1([CH2:48][OH:49])[CH2:43][CH2:44][CH2:45][CH2:46][CH2:47]1.[OH2:8].[OH:9][c:10]1[c:11]2[n:12][n:13][nH:14][c:15]2[cH:16][cH:17][cH:18]1>>[Cl:31][c:32]1[n:33][cH:34][c:35]([C:36](=[O:38])[NH:41][C:42]2([CH2:48][OH:49])[CH2:43][CH2:44][CH2:45][CH2:46][CH2:47]2)[cH:39][cH:40]1