HRID145122

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID15908

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

C8H17N3

HCID88958

5-Hydroxyindole-2-carboxylic acid

C9H7NO3

HCID15637150

未命名化合物

PRODUCTS

生成物

结构：O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1cc2cc(O)ccc2[nH]1

HCID14208234

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7dc6bb37e952438bb89c5ef6cc6e5f60
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

[CH2:35]([N:36]=[C:37]=[N:38][CH2:39][CH2:40][CH2:41][N:42]([CH3:43])[CH3:44])[CH3:45].[CH2:58]([Cl:59])[Cl:60].[CH3:46][CH2:47][N:48]([CH2:49][CH3:50])[CH2:51][CH3:52].[CH3:53][N:54]([CH3:55])[CH:56]=[O:57].[ClH:34].[NH2:1][CH:2]1[C:3](=[O:20])[NH:4][c:5]2[c:6]([cH:16][cH:17][cH:18][cH:19]2)[C:7]([c:9]2[c:10]([F:15])[cH:11][cH:12][cH:13][cH:14]2)=[N:8]1.[OH:21][c:22]1[cH:23][c:24]2[cH:25][c:26]([C:31](=[O:32])[OH:33])[nH:27][c:28]2[cH:29][cH:30]1>>[NH:1]([CH:2]1[C:3](=[O:20])[NH:4][c:5]2[c:6]([cH:16][cH:17][cH:18][cH:19]2)[C:7]([c:9]2[c:10]([F:15])[cH:11][cH:12][cH:13][cH:14]2)=[N:8]1)[C:31]([c:26]1[cH:25][c:24]2[cH:23][c:22]([OH:21])[cH:30][cH:29][c:28]2[nH:27]1)=[O:32]