HRID688115

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID8180

Undecanoic acid

C11H22O2

结构：CC(C)c1nc(CCO)n(C)c1Sc1cc(Cl)cc(Cl)c1

HCID474010

2-(5-(3,5-Dichlorophenylthio)-4-isopropyl-1-methyl-1H-imidazol-2-yl)ethanol

C15H18Cl2N2OS

HCID13945747

未命名化合物

PRODUCTS

生成物

结构：CCCCCCCCCCC(=O)OCCc1nc(C(C)C)c(Sc2cc(Cl)cc(Cl)c2)n1C

HCID69687123

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-0029062530e7446a9876757130cb78af
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

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