HRID96989

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID13387

N-Methyl-2-pyrrolidone

C5H9NO

HCID2736591

4-Chloro-6-fluoro-2-(trifluoromethyl)quinoline

C10H4ClF4N

HCID22641525

N-(4-Aminocyclohexyl)-3,5-difluorobenzamide

C13H16F2N2O

PRODUCTS

生成物

结构：O=C(NC1CCC(Nc2cc(C(F)(F)F)nc3ccc(F)cc23)CC1)c1cc(F)cc(F)c1

HCID22641563

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-298b52ad699d4117bba6e9f7a13d3ab1
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

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