HRID947728

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID8022

Ethyl isocyanate

C3H5NO

HCID8028

Tetrahydrofuran

C4H8O

HCID8471

Triethylamine

C6H15N

结构：O=C(c1ccc(C=Cc2n[nH]c3ccccc23)cc1)N1CCNCC1

HCID67089852

未命名化合物

PRODUCTS

生成物

结构：CCNC(=O)N1CCN(C(=O)c2ccc(C=Cc3n[nH]c4ccccc34)cc2)CC1

HCID67089915

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b9be910638a84784b1b78b652e81d8b5
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[CH2:33]([CH3:34])[N:35]=[C:36]=[O:37].[CH2:39]1[O:40][CH2:41][CH2:42][CH2:43]1.[CH3:26][CH2:27][N:28]([CH2:29][CH3:30])[CH2:31][CH3:32].[OH2:38].[nH:1]1[n:2][c:3]([CH:10]=[CH:11][c:12]2[cH:13][cH:14][c:15]([C:16](=[O:17])[N:18]3[CH2:19][CH2:20][NH:21][CH2:22][CH2:23]3)[cH:24][cH:25]2)[c:4]2[cH:5][cH:6][cH:7][cH:8][c:9]12>>[nH:1]1[n:2][c:3]([CH:10]=[CH:11][c:12]2[cH:13][cH:14][c:15]([C:16](=[O:17])[N:18]3[CH2:19][CH2:20][N:21]([C:36]([NH:35][CH2:33][CH3:34])=[O:37])[CH2:22][CH2:23]3)[cH:24][cH:25]2)[c:4]2[cH:5][cH:6][cH:7][cH:8][c:9]12