HRID2162341

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

HCID68263

1,1'-Carbonylbis(1H-imidazole)

C7H6N4O

结构：CC(C)(C)OC(=O)NC(CSC(c1ccccc1)(c1ccccc1)c1ccccc1)C(=O)O

HCID89557

未命名化合物

HCID5462224

Magnesium

HCID10888030

未命名化合物

PRODUCTS

生成物

结构：C=CCOC(=O)CC(=O)C(CSC(c1ccccc1)(c1ccccc1)c1ccccc1)NC(=O)OC(C)(C)C

HCID66649517

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-07765471203d40058c850278c09dd90a
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

[C:13]([CH3:14])([CH3:15])([CH3:16])[O:17][C:18](=[O:19])[NH:20][CH:21]([C:22]([OH:23])=[O:24])[CH2:25][S:26][C:27]([c:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1)([c:34]1[cH:35][cH:36][cH:37][cH:38][cH:39]1)[c:40]1[cH:41][cH:42][cH:43][cH:44][cH:45]1.[CH2:47]([CH:48]=[CH2:49])[O:50][C:51]([CH2:52][C:53](=[O:54])[OH:55])=[O:56].[CH2:57]1[O:58][CH2:59][CH2:60][CH2:61]1.[CH3:62][N:63]([c:64]1[cH:65][cH:66][n:67][cH:68][cH:69]1)[CH3:70].[Mg:46].[n:1]1([C:2]([n:3]2[cH:4][cH:5][n:6][cH:7]2)=[O:8])[cH:9][cH:10][n:11][cH:12]1>>[C:13]([CH3:14])([CH3:15])([CH3:16])[O:17][C:18](=[O:19])[NH:20][CH:21]([CH2:25][S:26][C:27]([c:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1)([c:34]1[cH:35][cH:36][cH:37][cH:38][cH:39]1)[c:40]1[cH:41][cH:42][cH:43][cH:44][cH:45]1)[C:53]([CH2:52][C:51]([O:50][CH2:47][CH:48]=[CH2:49])=[O:56])=[O:54]