HRID2311529

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID962

Water

H2O

HCID6212

Chloroform

CHCl3

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

HCID15908

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

C8H17N3

HCID3041175

2,4-Dichloroamphetamine

C9H11Cl2N

HCID53630860

3-(Trifluoromethyl)pyrazine-2-carboxylic acid

C6H3F3N2O2

PRODUCTS

生成物

结构：CC(Cc1ccc(Cl)cc1Cl)NC(=O)c1nccnc1C(F)(F)F

HCID16742597

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f3737a5fc2fb4c2e90e86100c2d57c62
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

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