HRID98809

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID8022

Ethyl isocyanate

C3H5NO

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

结构：COC(=O)C(C)(C)NC(=O)C(Cc1ccc(OCc2ccccc2)c(O)c1)NC(=O)OC(C)(C)C

HCID68725932

未命名化合物

PRODUCTS

生成物

结构：CCNC(=O)Oc1cc(CC(NC(=O)OC(C)(C)C)C(=O)NC(C)(C)C(=O)OC)ccc1OCc1ccccc1

HCID68767360

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-72497de6b1874f4c90b6079550aaa6e3
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[CH2:36]([CH3:37])[N:38]=[C:39]=[O:40].[CH3:1][O:2][C:3]([C:4]([CH3:5])([CH3:6])[NH:7][C:8]([CH:9]([CH2:10][c:11]1[cH:12][c:13]([OH:25])[c:14]([O:17][CH2:18][c:19]2[cH:20][cH:21][cH:22][cH:23][cH:24]2)[cH:15][cH:16]1)[NH:26][C:27](=[O:28])[O:29][C:30]([CH3:31])([CH3:32])[CH3:33])=[O:34])=[O:35].[CH3:44][N:45]([c:46]1[cH:47][cH:48][n:49][cH:50][cH:51]1)[CH3:52].[Cl:41][CH2:42][Cl:43]>>[CH3:1][O:2][C:3]([C:4]([CH3:5])([CH3:6])[NH:7][C:8]([CH:9]([CH2:10][c:11]1[cH:12][c:13]([O:25][C:39]([NH:38][CH2:36][CH3:37])=[O:40])[c:14]([O:17][CH2:18][c:19]2[cH:20][cH:21][cH:22][cH:23][cH:24]2)[cH:15][cH:16]1)[NH:26][C:27](=[O:28])[O:29][C:30]([CH3:31])([CH3:32])[CH3:33])=[O:34])=[O:35]