HRID192343

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID297

Methane

CH4

HCID8028

Tetrahydrofuran

C4H8O

HCID8471

Triethylamine

C6H15N

HCID23938

Palladium

HCID2760083

5-methylthiophene-2-carbonyl chloride

C6H5ClOS

HCID14062544

未命名化合物

HCID14390203

未命名化合物

PRODUCTS

生成物

HCID15617199

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6159999d3e654ad5878b122374448f0f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[C:47].[CH2:17]([CH3:18])[O:19][C:20]([CH2:21][NH:22][c:23]1[n:24][cH:25][cH:26][cH:27][c:28]1[NH2:29])=[O:30].[CH2:31]([O:32][C:33](=[O:34])[CH2:35][NH:36][c:37]1[c:38]([N+:39]([O-:40])=[O:41])[cH:42][cH:43][cH:44][n:45]1)[CH3:46].[CH3:1][CH2:2][N:3]([CH2:4][CH3:5])[CH2:6][CH3:7].[CH3:8][c:9]1[cH:10][cH:11][c:12]([C:14](=[O:15])[Cl:16])[s:13]1.[O:49]1[CH2:50][CH2:51][CH2:52][CH2:53]1.[Pd:48]>>[CH3:8][c:9]1[cH:10][cH:11][c:12]([C:14](=[O:15])[NH:29][c:28]2[c:23]([NH:22][CH2:21][C:20]([O:19][CH2:17][CH3:18])=[O:30])[n:24][cH:25][cH:26][cH:27]2)[s:13]1