HRID937617

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID702

Ethanol

C2H6O

HCID22770

3,4-Dimethoxyaniline

C8H11NO2

HCID53471832

5-Methyl-2-(methylsulfanyl)-7-phenylimidazo[5,1-f][1,2,4]triazine

C13H12N4S

结构：Cc1nc(-c2ccccc2)n2nc(S(C)(=O)=O)ncc12

HCID53471833

2-(Methanesulfonyl)-5-methyl-7-phenylimidazo[5,1-f][1,2,4]triazine

C13H12N4O2S

PRODUCTS

生成物

结构：COc1ccc(Nc2ncc3c(C)nc(-c4ccccc4)n3n2)cc1OC

HCID11405758

N-(3,4-Dimethoxyphenyl)-5-methyl-7-phenylimidazo[5,1-f][1,2,4]triazin-2-amine

C20H19N5O2

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-42d90be6c2134eda8975e913cbb97bfc
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[CH3:19][c:20]1[n:21][c:22](-[c:23]2[cH:24][cH:25][cH:26][cH:27][cH:28]2)[n:29]2[c:30]1[cH:31][n:32][c:33]([S:34]([CH3:35])(=[O:36])=[O:37])[n:38]2.[CH3:1][c:2]1[n:3][c:4](-[c:13]2[cH:14][cH:15][cH:16][cH:17][cH:18]2)[n:5]2[n:6][c:7]([S:11][CH3:12])[n:8][cH:9][c:10]12.[CH3:39][O:40][c:41]1[cH:42][c:43]([NH2:44])[cH:45][cH:46][c:47]1[O:48][CH3:49].[CH3:50][CH2:51][OH:52]>>[CH3:1][c:2]1[n:3][c:4](-[c:13]2[cH:14][cH:15][cH:16][cH:17][cH:18]2)[n:5]2[n:6][c:7]([NH:44][c:43]3[cH:42][c:41]([O:40][CH3:39])[c:47]([O:48][CH3:49])[cH:46][cH:45]3)[n:8][cH:9][c:10]12