HRID164237

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID7412

Benzoyl chloride

C7H5ClO

HCID8028

Tetrahydrofuran

C4H8O

HCID8471

Triethylamine

C6H15N

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

HCID86642525

未命名化合物

PRODUCTS

生成物

结构：CCN(CC)Cc1nc(NC(=O)c2ccccc2)sc1C(=O)NCc1ccccc1

HCID59369654

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3eb07aeb58384b3ab99b22aec5a35333
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

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