HRID87513

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8857

Ethyl acetate

C4H8O2

HCID19660

Carbonate

CO3-2

HCID80977

4-Chloro-2-phenylquinazoline

C14H9ClN2

HCID22125206

未命名化合物

PRODUCTS

生成物

结构：CN1C(=O)CCC2(C)c3ccc(Sc4nc(-c5ccccc5)nc5ccccc45)cc3CCC12

HCID178481466

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6ba961956c1748c2bfca071d35f59870
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:19](=[O:20])([O-:21])[O-:22].[CH3:1][N:2]1[C:3](=[O:18])[CH2:4][CH2:5][C:6]2([CH3:17])[c:7]3[c:8]([cH:12][c:13]([SH:16])[cH:14][cH:15]3)[CH2:9][CH2:10][CH:11]12.[CH3:42][N:43]([CH3:44])[CH:45]=[O:46].[CH3:47][CH2:48][O:49][C:50](=[O:51])[CH3:52].[Cl:25][c:26]1[n:27][c:28](-[c:36]2[cH:37][cH:38][cH:39][cH:40][cH:41]2)[n:29][c:30]2[cH:31][cH:32][cH:33][cH:34][c:35]12.[K+:23].[K+:24]>>[CH3:1][N:2]1[C:3](=[O:18])[CH2:4][CH2:5][C:6]2([CH3:17])[c:7]3[c:8]([cH:12][c:13]([S:16][c:26]4[n:27][c:28](-[c:36]5[cH:37][cH:38][cH:39][cH:40][cH:41]5)[n:29][c:30]5[cH:31][cH:32][cH:33][cH:34][c:35]45)[cH:14][cH:15]3)[CH2:9][CH2:10][CH:11]12