HRID2343513

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID7504

Benzylamine

C7H9N

HCID7972

4-Methylmorpholine

C5H11NO

HCID8028

Tetrahydrofuran

C4H8O

HCID18450

2-Chloro-4,6-dimethoxy-1,3,5-triazine

C5H6ClN3O2

HCID82226332

未命名化合物

PRODUCTS

生成物

结构：Cc1nc(NC(=O)c2ccncc2)sc1C(=O)NCc1ccccc1

HCID1468261

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-debca69b965148cc8eeaad17461eacb3
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

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