HRID681736

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID66589

1-Isocyanatonaphthalene

C11H7NO

HCID57260083

未命名化合物

PRODUCTS

生成物

结构：O=C(C=Cc1cccnc1)NCCCCC1CCN(C(=O)Nc2cccc3ccccc23)CC1

HCID54033739

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d8cbc5dd4fe14f96ae503545cfc5a206
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

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