HRID1537252

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID2795424

1-Methyl-5-aminomethylimidazole

C5H9N3

结构：CC(Oc1ccc(C(F)(F)F)cn1)C1CN(C(=O)Cl)CC1c1ccc(Cl)c(Cl)c1

HCID86628182

未命名化合物

PRODUCTS

生成物

结构：CC(Oc1ccc(C(F)(F)F)cn1)C1CN(C(=O)NCc2cncn2C)CC1c1ccc(Cl)c(Cl)c1

HCID67327884

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-26f44732ee044b4c86156ddff76e2e5d
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

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