HRID815469

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID9773

Ethanamine, 2,2,2-trifluoro-

C2H4F3N

HCID24386

Thionyl chloride

Cl2OS

结构：CN(C)c1cc2c(cc1C(F)(F)F)NC(=O)CC(c1cccc(-n3nncc3CO)c1)=N2

HCID18613377

未命名化合物

PRODUCTS

生成物

结构：CN(C)c1cc2c(cc1C(F)(F)F)NC(=O)CC(c1cccc(-n3nncc3CNCC(F)(F)F)c1)=N2

HCID18613513

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c9a7eb08d4d443b0a5828770102298d1
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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