HRID92322

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID736536

2-(chloromethyl)-1-methyl-1H-imidazole

C5H7ClN2

结构：Cc1ccccc1N1CNC(=O)C12CCN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)CC2

HCID10163137

未命名化合物

PRODUCTS

生成物

结构：Cc1ccccc1N1CN(Cc2nccn2C)C(=O)C12CCN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)CC2

HCID86584186

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-17c925ca559149369d06dd56a573a52f
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

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