HRID2312016

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8471

Triethylamine

C6H15N

HCID65741

Diphenylcarbamyl chloride

C13H10ClNO

HCID2758484

6,7-dimethoxy-4-piperazin-1-yl-quinazoline

C14H18N4O2

PRODUCTS

生成物

结构：COc1cc2ncnc(N3CCN(C(=O)N(c4ccccc4)c4ccccc4)CC3)c2cc1OC

HCID22707615

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b86d02a581aa4bd49cb07a5019e55118
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:6]([N:15]3[CH2:16][CH2:17][NH:18][CH2:19][CH2:20]3)[n:7][cH:8][n:9][c:10]2[cH:11][c:12]1[O:13][CH3:14].[CH3:21][CH2:22][N:23]([CH2:24][CH3:25])[CH2:26][CH3:27].[CH3:45][N:46]([CH3:47])[CH:48]=[O:49].[OH2:44].[c:28]1([N:34]([C:35](=[O:36])[Cl:37])[c:38]2[cH:39][cH:40][cH:41][cH:42][cH:43]2)[cH:29][cH:30][cH:31][cH:32][cH:33]1>>[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:6]([N:15]3[CH2:16][CH2:17][N:18]([C:35]([N:34]([c:28]4[cH:29][cH:30][cH:31][cH:32][cH:33]4)[c:38]4[cH:39][cH:40][cH:41][cH:42][cH:43]4)=[O:36])[CH2:19][CH2:20]3)[n:7][cH:8][n:9][c:10]2[cH:11][c:12]1[O:13][CH3:14]