HRID146757

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID3283

Diethyl Ether

C4H10O

HCID8028

Tetrahydrofuran

C4H8O

HCID66460

Guanidine, N,N,N',N'-tetramethyl-

C5H13N3

HCID2776249

2,4-dimethylthiazole-5-carbaldehyde

C6H7NOS

结构：COC(=O)C(NC(=O)c1ccc(C(O)CCc2cccc(O)c2)cc1Cl)P(=O)(OC)OC

HCID18673037

未命名化合物

PRODUCTS

生成物

结构：COC(=O)C(=Cc1sc(C)nc1C)NC(=O)c1ccc(C(O)CCc2cccc(O)c2)cc1Cl

HCID72497462

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-da36e808028f4dfa85ba92815d7e5939
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

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