HRID107584

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID3776

Isopropanol

C3H8O

HCID9115261

3-methyl-4-(4-methylpiperazin-1-yl)aniline

C12H19N3

HCID86621814

未命名化合物

PRODUCTS

生成物

结构：Cc1cc(Nc2ncc(F)c(Nc3ccccc3C(=O)NC(C)C)n2)ccc1N1CCN(C)CC1

HCID57974207

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-884e3f98560e476f9f1781e18daf56fc
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

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