HRID301272

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID7993

3-(Dimethylamino)propylamine

C5H14N2

HCID8028

Tetrahydrofuran

C4H8O

结构：O=C(O)c1cn(C(c2ccccc2)(c2ccccc2)c2ccccc2)c(F)n1

HCID20432404

未命名化合物

PRODUCTS

生成物

结构：CN(C)CCCNC(=O)c1cn(C(c2ccccc2)(c2ccccc2)c2ccccc2)c(F)n1

HCID20432441

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f13d6b8f2ae240f096447efd723f3b4c
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

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