HRID671993

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID6363

Isopropylamine

C3H9N

结构：CC(=O)N(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C1CCCN(C(=O)Cl)c2cc(Cl)ccc21

HCID86616083

未命名化合物

PRODUCTS

生成物

结构：CC(=O)N(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C1CCCN(C(=O)NC(C)C)c2cc(Cl)ccc21

HCID59003115

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c3d1f372bcb4495fac89cf9d13111a81
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

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