HRID109867

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID961

Hydroxide

HO-

HCID7237

o-Xylene

C8H10

HCID7954

2,4,6-Trichloro-s-triazine

C3Cl3N3

结构：CC1(C)CC(NC2CC(C)(C)NC(C)(C)C2)CC(C)(C)N1

HCID566708

未命名化合物

PRODUCTS

生成物

结构：CC1(C)CC(N(c2nc(Cl)nc(Cl)n2)C2CC(C)(C)NC(C)(C)C2)CC(C)(C)N1

HCID14365120

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ab5a2fb710c2448788b5314ae6f13600
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

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