HRID114089

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8471

Triethylamine

C6H15N

HCID31275

1,4-Dioxane

C4H8O2

HCID66024

Benzenemethanamine, N-(1-methylethyl)-

C10H15N

HCID21712446

未命名化合物

PRODUCTS

生成物

结构：CC(C)N(Cc1ccccc1)C(=O)c1cnc(N2CCOCC2)nc1-c1ccccc1Cl

HCID11690962

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f70cc00f2fa44b4a9d25705b6c310ae5
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

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