HRID837510

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID241

Benzene

C6H6

HCID1140

Toluene

C7H8

HCID6101

4-Methylbenzenesulfonic acid

C7H8O3S

HCID70264

Cyclohexene, 1-methoxy-

C7H12O

HCID473916

{5-[(3,5-Dichlorophenyl)sulfanyl]-1-methyl-4-(propan-2-yl)-1H-imidazol-2-yl}methanol

C14H16Cl2N2OS

HCID4989215

Pyridinium

C5H6N+

PRODUCTS

生成物

结构：CC(C)c1nc(COC2=CCCCC2)n(C)c1Sc1cc(Cl)cc(Cl)c1

HCID18791989

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c5ba3feb41fd42e8b79ce5e02e55d9c6
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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