HRID120977

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID8082

Piperidine

C5H11N

HCID240704

2-sec-butylbenzenethiol

C10H14S

结构：O=C1OC(CCc2ccccc2)(c2ccccc2)CC(O)=C1Br

HCID54721639

未命名化合物

PRODUCTS

生成物

结构：CCC(C)c1ccccc1SC1=C(O)CC(CCc2ccccc2)(c2ccccc2)OC1=O

HCID54689015

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-604822c3444c49a4bddb93687ffe9e79
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

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