HRID310896

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1049

Pyridine

C5H5N

HCID15908

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

C8H17N3

HCID643373

2-methylnicotinic acid

C7H7NO2

结构：Nc1cc(Cl)cc2c1[nH]c1cncc(NC(=O)C(F)(F)F)c12

HCID86595095

未命名化合物

PRODUCTS

生成物

结构：Cc1ncccc1C(=O)Nc1cc(Cl)cc2c1[nH]c1cncc(NC(=O)C(F)(F)F)c12

HCID86595096

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5994fc2b647e48c0b1cf112da680b438
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

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