HRID318134

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8471

Triethylamine

C6H15N

HCID11112

Nicotinic acid hydrazide

C6H7N3O

HCID15908

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

C8H17N3

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID44630704

5-Chloro-1H-pyrrolo[2,3-c]pyridine-2-carboxylic acid

C8H5ClN2O2

PRODUCTS

生成物

结构：O=C(NNC(=O)c1cc2cc(Cl)ncc2[nH]1)c1cccnc1

HCID59830438

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3c6a7bcc39b348c1833df28355a260a4
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[C:1]([c:2]1[cH:3][n:4][cH:5][cH:6][cH:7]1)(=[O:8])[NH:9][NH2:10].[CH3:11][CH2:12][N:13]([CH2:14][CH3:15])[CH2:16][CH3:17].[CH3:41][CH2:42][N:43]=[C:44]=[N:45][CH2:46][CH2:47][CH2:48][N:49]([CH3:50])[CH3:51].[Cl:18][c:19]1[cH:20][c:21]2[c:22]([cH:23][n:24]1)[nH:25][c:26]([C:28](=[O:29])[OH:30])[cH:27]2.[O:52]=[CH:53][N:54]([CH3:55])[CH3:56].[OH:31][n:32]1[c:33]2[c:34]([cH:35][cH:36][cH:37][cH:38]2)[n:39][n:40]1>>[C:1]([c:2]1[cH:3][n:4][cH:5][cH:6][cH:7]1)(=[O:8])[NH:9][NH:10][C:28]([c:26]1[nH:25][c:22]2[c:21]([cH:20][c:19]([Cl:18])[n:24][cH:23]2)[cH:27]1)=[O:29]