HRID1575929

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID11568

3-Aminophenol

C6H7NO

结构：Cc1cc(C(=O)Nc2cccc(C(=O)c3ccc4c(c3)NC(=O)C4=CO)c2)n(C(C)(C)C)n1

HCID178426963

未命名化合物

PRODUCTS

生成物

结构：Cc1cc(C(=O)Nc2cccc(C(=O)c3ccc4c(c3)NC(=O)C4=CNc3cccc(O)c3)c2)n(C(C)(C)C)n1

HCID178426947

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a1a9283a27dc46e6a59876e12d4afbdf
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

[CH2:42]1[O:43][CH2:44][CH2:45][CH2:46]1.[NH2:34][c:35]1[cH:36][cH:37][cH:38][c:39]([OH:40])[cH:41]1.[OH:1][CH:2]=[C:3]1[C:4](=[O:33])[NH:5][c:6]2[cH:7][c:8]([C:12](=[O:13])[c:14]3[cH:15][c:16]([NH:20][C:21](=[O:22])[c:23]4[n:24]([C:29]([CH3:30])([CH3:31])[CH3:32])[n:25][c:26]([CH3:28])[cH:27]4)[cH:17][cH:18][cH:19]3)[cH:9][cH:10][c:11]21>>[CH:2](=[C:3]1[C:4](=[O:33])[NH:5][c:6]2[cH:7][c:8]([C:12](=[O:13])[c:14]3[cH:15][c:16]([NH:20][C:21](=[O:22])[c:23]4[n:24]([C:29]([CH3:30])([CH3:31])[CH3:32])[n:25][c:26]([CH3:28])[cH:27]4)[cH:17][cH:18][cH:19]3)[cH:9][cH:10][c:11]21)[NH:34][c:35]1[cH:36][cH:37][cH:38][c:39]([OH:40])[cH:41]1