HRID2346641

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID8028

Tetrahydrofuran

C4H8O

HCID11325

1H-Isoindole-1,3(2H)-dione, 2-(2-bromoethyl)-

C10H8BrNO2

HCID19660

Carbonate

CO3-2

结构：CCC(NC(=O)c1c(O)c(-c2ccccc2)nc2ccccc12)c1ccccc1

HCID133090

未命名化合物

PRODUCTS

生成物

结构：CCC(NC(=O)c1c(OCCN2C(=O)c3ccccc3C2=O)c(-c2ccccc2)nc2ccccc12)c1ccccc1

HCID21710496

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-452b2590793d4c5f88d29c044a1f2c43
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

[Br:30][CH2:31][CH2:32][N:33]1[C:34](=[O:43])[c:35]2[c:36]([cH:39][cH:40][cH:41][cH:42]2)[C:37]1=[O:38].[CH2:1]([CH3:2])[CH:3]([c:4]1[cH:5][cH:6][cH:7][cH:8][cH:9]1)[NH:10][C:11](=[O:12])[c:13]1[c:14]([OH:29])[c:15](-[c:23]2[cH:24][cH:25][cH:26][cH:27][cH:28]2)[n:16][c:17]2[cH:18][cH:19][cH:20][cH:21][c:22]12.[CH2:50]1[O:51][CH2:52][CH2:53][CH2:54]1.[K+:44].[K+:45].[O-:46][C:47]([O-:48])=[O:49]>>[CH2:1]([CH3:2])[CH:3]([c:4]1[cH:5][cH:6][cH:7][cH:8][cH:9]1)[NH:10][C:11](=[O:12])[c:13]1[c:14]([O:29][CH2:31][CH2:32][N:33]2[C:34](=[O:43])[c:35]3[c:36]([cH:39][cH:40][cH:41][cH:42]3)[C:37]2=[O:38])[c:15](-[c:23]2[cH:24][cH:25][cH:26][cH:27][cH:28]2)[n:16][c:17]2[cH:18][cH:19][cH:20][cH:21][c:22]12