HRID1145843

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID19660

Carbonate

CO3-2

HCID104967

Cesium(1+)

Cs+

2 次

结构：O=C(NC(C(=O)NCc1ccccc1)C(=O)NCc1ccccc1)C(Br)Cc1ccccc1

HCID18348093

未命名化合物

HCID178418634

未命名化合物

PRODUCTS

生成物

结构：CC(=S)C(Cc1ccccc1)C(=O)NC(C(=O)NCc1ccccc1)C(=O)NCc1ccccc1

HCID18348133

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6ca9e305de374158bb9967b5d955f148
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

[C:34]([CH3:35])(=[S:36])[OH:37].[C:38](=[O:39])([O-:40])[O-:41].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[NH:8][C:9]([CH:10]([C:11](=[O:12])[NH:13][CH2:14][c:15]1[cH:16][cH:17][cH:18][cH:19][cH:20]1)[NH:21][C:22]([CH:23]([CH2:24][c:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1)[Br:31])=[O:32])=[O:33].[CH3:44][N:45]([CH3:46])[CH:47]=[O:48].[Cs+:42].[Cs+:43].[OH2:49]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[NH:8][C:9]([CH:10]([C:11](=[O:12])[NH:13][CH2:14][c:15]1[cH:16][cH:17][cH:18][cH:19][cH:20]1)[NH:21][C:22]([CH:23]([CH2:24][c:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1)[C:34]([CH3:35])=[S:36])=[O:32])=[O:33]