HRID693858

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID693288

2-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)aniline

C12H16F3N3

HCID58587930

未命名化合物

PRODUCTS

产物

HCID58588304

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-4ca6700cbac74124af6d15bd36eace55
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

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