HRID702334

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID2773430

5-Formyl-2-thiopheneboronic acid

C5H5BO3S

结构：CCCCN(CCCC)c1ccc2c(c1)C(CCCC)(CCCC)c1cc(Br)ccc1-2

HCID58239559

未命名化合物

PRODUCTS

生成物

结构：CCCCN(CCCC)c1ccc2c(c1)C(CCCC)(CCCC)c1cc(-c3ccc(C=O)s3)ccc1-2

HCID86641779

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-724a1825d6814146b8ebbc3d6858827b
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

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