HRID103053

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID7464

Cumidine

C9H13N

HCID8471

Triethylamine

C6H15N

HCID15908

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

C8H17N3

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID79222

6-Chloronicotinic acid

C6H4ClNO2

PRODUCTS

生成物

HCID2473921

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8edbaa6e10f84e01b02d4764110e4ca0
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

[CH2:33]([N:34]=[C:35]=[N:36][CH2:37][CH2:38][CH2:39][N:40]([CH3:41])[CH3:42])[CH3:43].[CH3:49][CH2:50][N:51]([CH2:52][CH3:53])[CH2:54][CH3:55].[CH:11]([CH3:12])([CH3:13])[c:14]1[cH:15][cH:16][c:17]([NH2:18])[cH:19][cH:20]1.[Cl:1][c:2]1[n:3][cH:4][c:5]([C:6](=[O:7])[OH:8])[cH:9][cH:10]1.[ClH:32].[O:44]=[CH:45][N:46]([CH3:47])[CH3:48].[OH2:21].[OH:22][n:23]1[c:24]2[cH:25][cH:26][cH:27][cH:28][c:29]2[n:30][n:31]1>>[Cl:1][c:2]1[n:3][cH:4][c:5]([C:6](=[O:8])[NH:18][c:17]2[cH:16][cH:15][c:14]([CH:11]([CH3:12])[CH3:13])[cH:20][cH:19]2)[cH:9][cH:10]1