HRID113950

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1140

Toluene

C7H8

HCID8058

n-Hexane

C6H14

HCID8857

Ethyl acetate

C4H8O2

HCID69695

Benzene, 1-isocyanato-2-methoxy-

C8H7NO2

HCID11616363

4-[(6,7-Dimethoxy-4-quinazolinyl)oxy]benzenamine

C16H15N3O3

PRODUCTS

生成物

结构：COc1ccccc1NC(=O)Nc1ccc(Oc2ncnc3cc(OC)c(OC)cc23)cc1

HCID22667241

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d9b6ab6d572f4705991a17f6641871b7
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

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