HRID669016

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11

1,2-Dichloroethane

C2H4Cl2

HCID6344

Dichloromethane

CH2Cl2

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID81531

Diisopropylethylamine

C8H19N

HCID14612677

1,2,3,4-Tetrahydro-4-methyl-1-phenylisoquinoline

C16H17N

HCID43397104

未命名化合物

PRODUCTS

生成物

结构：CC1CN(C(=O)CCC(=O)NCc2cccc(C(F)(F)F)c2)C(c2ccccc2)c2ccccc21

HCID46829731

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8d5ae5fce7b74a5ca1c9fda6728fe7b3
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

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