HRID1541606

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID7900

1-Methoxy-2-propanol

C4H10O2

HCID81531

Diisopropylethylamine

C8H19N

HCID22124604

4-[3-(4-Methylpiperazin-1-yl)propoxy]aniline

C14H23N3O

HCID66711275

未命名化合物

PRODUCTS

生成物

结构：CN1CCN(CCCOc2ccc(Nc3ncc4ccc(-c5cccnc5)n4n3)cc2)CC1

HCID66711162

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-52d398c162754e798c7ad20db5932ac5
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

[CH3:19][N:20]1[CH2:21][CH2:22][N:23]([CH2:26][CH2:27][CH2:28][O:29][c:30]2[cH:31][cH:32][c:33]([NH2:36])[cH:34][cH:35]2)[CH2:24][CH2:25]1.[CH3:1][S:2](=[O:3])[c:4]1[n:5][n:6]2[c:7]([cH:8][n:9]1)[cH:10][cH:11][c:12]2-[c:13]1[cH:14][n:15][cH:16][cH:17][cH:18]1.[CH3:37][O:38][CH2:39][CH:40]([OH:41])[CH3:42].[CH:43]([N:44]([CH2:45][CH3:46])[CH:47]([CH3:48])[CH3:49])([CH3:50])[CH3:51]>>[c:4]1([NH:36][c:33]2[cH:32][cH:31][c:30]([O:29][CH2:28][CH2:27][CH2:26][N:23]3[CH2:22][CH2:21][N:20]([CH3:19])[CH2:25][CH2:24]3)[cH:35][cH:34]2)[n:5][n:6]2[c:7]([cH:8][n:9]1)[cH:10][cH:11][c:12]2-[c:13]1[cH:14][n:15][cH:16][cH:17][cH:18]1