HRID1207931

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID887

Methanol

CH4O

HCID7283

2-Methylbutylamine

C5H13N

HCID2773430

5-Formyl-2-thiopheneboronic acid

C5H5BO3S

结构：CCC(C)CNCc1ccc(-c2cc(C(N)=O)c3[nH]cc(C4CCN(S(=O)(=O)CC)CC4)c3c2)s1

HCID57732791

未命名化合物

HCID66722882

未命名化合物

PRODUCTS

生成物

HCID66722974

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ec215ba30294408bbe4177b3c8d57a63
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

[CH2:13]([S:14]([N:15]1[CH2:16][CH2:17][CH:18]([c:19]2[c:20]3[c:21]([c:22]([C:23]([NH2:24])=[O:25])[cH:26][c:27](-[c:33]4[s:34][c:35]([CH2:38][NH:39][CH2:40][CH:41]([CH2:42][CH3:43])[CH3:44])[cH:36][cH:37]4)[cH:28]3)[nH:29][cH:30]2)[CH2:31][CH2:32]1)(=[O:45])=[O:46])[CH3:47].[CH2:1]([NH:2][CH2:3][c:4]1[s:5][c:6]([B:10]([OH:11])[OH:12])[cH:7][cH:8]1)[CH3:9].[CH3:58][CH:59]([CH2:60][CH3:61])[CH2:62][NH2:63].[CH3:64][OH:65].[CH:48]([c:49]1[s:50][c:51]([B:52]([OH:53])[OH:54])[cH:55][cH:56]1)=[O:57]>>[B:10]([OH:11])([OH:12])[c:33]1[s:34][c:35]([CH2:38][NH:39][CH2:40][CH:41]([CH2:42][CH3:43])[CH3:44])[cH:36][cH:37]1