HRID134913

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6212

Chloroform

CHCl3

HCID8471

Triethylamine

C6H15N

HCID87984

N-Ethyl-N-(3-methylphenyl)ethane-1,2-diamine

C11H18N2

HCID94429

Triphosgene

C3Cl6O3

HCID11616363

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

C16H15N3O3

PRODUCTS

生成物

结构：CCN(CCNC(=O)Nc1ccc(Oc2ncnc3cc(OC)c(OC)cc23)cc1)c1cccc(C)c1

HCID21891051

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-72d92c763c9c46a48277b2eb98e98c44
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

[CH2:42]([CH3:43])[N:44]([CH2:45][CH2:46][NH2:47])[c:48]1[cH:49][c:50]([CH3:54])[cH:51][cH:52][cH:53]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]([NH2:20])[cH:21][cH:22]3)[n:7][cH:8][n:9][c:10]2[cH:11][c:12]1[O:13][CH3:14].[CH3:23][CH2:24][N:25]([CH2:26][CH3:27])[CH2:28][CH3:29].[CH:55]([Cl:56])([Cl:57])[Cl:58].[Cl:30][C:31]([Cl:32])([O:33][C:34]([O:35][C:36]([Cl:37])([Cl:38])[Cl:39])=[O:40])[Cl:41].[OH2:59]>>[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:20][C:34](=[O:40])[NH:47][CH2:46][CH2:45][N:44]([CH2:42][CH3:43])[c:48]4[cH:49][c:50]([CH3:54])[cH:51][cH:52][cH:53]4)[cH:21][cH:22]3)[n:7][cH:8][n:9][c:10]2[cH:11][c:12]1[O:13][CH3:14]