HRID1553342

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11528441

2-(1,3-Dimethylbutyl)aniline

C12H19N

反应SMILES：C=C(CC(C)C)c1ccccc1NC(=O)c1cn(C)nc1C(F)(F)F

HCID21841534

未命名化合物

HCID21841537

未命名化合物

HCID53688512

未命名化合物

PRODUCTS

产物

HCID53966740

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-6197a4e595744c978239fd3f6bb84938
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应SMILES

[CH3:14][CH:15]([CH3:16])[CH2:17][C:18]([c:19]1[cH:20][cH:21][cH:22][cH:23][c:24]1[NH2:25])=[CH2:26].[CH3:1][CH:2]([c:3]1[cH:4][cH:5][cH:6][cH:7][c:8]1[NH2:9])[CH2:10][CH:11]([CH3:12])[CH3:13].[CH3:27][C:28]([c:29]1[cH:30][cH:31][cH:32][cH:33][c:34]1[NH2:35])=[CH:36][CH:37]([CH3:38])[CH3:39].[CH3:40][CH:41]([CH2:42][C:43](=[CH2:44])[c:45]1[c:46]([NH:51][C:52](=[O:53])[c:54]2[c:55]([C:60]([F:61])([F:62])[F:63])[n:56][n:57]([CH3:59])[cH:58]2)[cH:47][cH:48][cH:49][cH:50]1)[CH3:64]>>[CH3:40][CH:41]([CH:42]=[C:43]([CH3:44])[c:45]1[c:46]([NH:51][C:52](=[O:53])[c:54]2[c:55]([C:60]([F:61])([F:62])[F:63])[n:56][n:57]([CH3:59])[cH:58]2)[cH:47][cH:48][cH:49][cH:50]1)[CH3:64]