HRID104247

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID402

Hydrogen sulfide

H2S

HCID1049

Pyridine

C5H5N

HCID8471

Triethylamine

C6H15N

结构：Cc1cc(OCC(=O)OC(C)(C)C)ccc1NC(=O)NC(=O)c1ccc(C#N)cc1

HCID23370039

未命名化合物

PRODUCTS

生成物

结构：Cc1cc(OCC(=O)OC(C)(C)C)ccc1NC(=O)NC(=O)c1ccc(C(N)=S)cc1

HCID23369996

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c20f053f9200422d8054a772d352601c
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:1](#[N:2])[c:3]1[cH:4][cH:5][c:6]([C:7](=[O:8])[NH:9][C:10]([NH:11][c:12]2[c:13]([CH3:27])[cH:14][c:15]([O:16][CH2:17][C:18](=[O:19])[O:20][C:21]([CH3:22])([CH3:23])[CH3:24])[cH:25][cH:26]2)=[O:28])[cH:29][cH:30]1.[CH3:38][CH2:39][N:40]([CH2:41][CH3:42])[CH2:43][CH3:44].[SH2:37].[cH:31]1[cH:32][cH:33][n:34][cH:35][cH:36]1>>[C:1]([NH2:2])([c:3]1[cH:4][cH:5][c:6]([C:7](=[O:8])[NH:9][C:10]([NH:11][c:12]2[c:13]([CH3:27])[cH:14][c:15]([O:16][CH2:17][C:18](=[O:19])[O:20][C:21]([CH3:22])([CH3:23])[CH3:24])[cH:25][cH:26]2)=[O:28])[cH:29][cH:30]1)=[S:37]