HRID2157657

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1049

Pyridine

C5H5N

HCID6344

Dichloromethane

CH2Cl2

HCID8028

Tetrahydrofuran

C4H8O

HCID21885

2-Dimethylaminopyridine

C7H10N2

HCID210824

N-Benzyl-2-imino-4-methyl-2,3-dihydro-1,3-thiazole-5-carboximidic acid

C12H13N3OS

HCID10965460

5-phenylpentanoyl Chloride

C11H13ClO

PRODUCTS

生成物

结构：Cc1nc(NC(=O)CCCCc2ccccc2)sc1C(=O)NCc1ccccc1

HCID59369684

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b8dff548714b4cbdb4dd21fcd342b5f8
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

[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]([CH3:17])[n:13][c:14]([NH2:16])[s:15]1.[CH3:24][N:25]([c:26]1[cH:27][cH:28][cH:29][cH:30][n:31]1)[CH3:32].[Cl:51][CH2:52][Cl:53].[O:46]1[CH2:47][CH2:48][CH2:49][CH2:50]1.[c:33]1([CH2:39][CH2:40][CH2:41][CH2:42][C:43](=[O:44])[Cl:45])[cH:34][cH:35][cH:36][cH:37][cH:38]1.[cH:18]1[cH:19][cH:20][n:21][cH:22][cH:23]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]([CH3:17])[n:13][c:14]([NH:16][C:43]([CH2:42][CH2:41][CH2:40][CH2:39][c:33]2[cH:34][cH:35][cH:36][cH:37][cH:38]2)=[O:44])[s:15]1