HRID2346734

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID45791153

3-Methyl-1-(pyridin-3-yl)butan-1-amine

C10H16N2

结构：CC(C)(NC(=O)c1ccc(N2CC(F)(F)C2)c(OCC2CC2)n1)c1nccs1

HCID71105580

未命名化合物

PRODUCTS

生成物

结构：CC(C)CC(NC(=O)c1ccc(N2CC(F)(F)C2)c(OCC2CC2)n1)c1cccnc1

HCID71105706

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-11cf020f385547ce9c4b64097a115c70
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

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