HRID678417

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID3776

Isopropanol

C3H8O

HCID11424434

3-Methyl-4-[(6-methylpyridin-3-yl)oxy]aniline

C13H14N2O

HCID86615689

未命名化合物

PRODUCTS

生成物

结构：CC(=O)N(C)CCOc1cccc2ncnc(Nc3ccc(Oc4ccc(C)nc4)c(C)c3)c12

HCID11408478

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-bd2582cfdce34454a05c7f1748133490
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

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