HRID193463

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID180

Acetone

C3H6O

HCID8471

Triethylamine

C6H15N

HCID240534

1H-Isoindole-1,3(2H)-dione,2-(4-bromopentyl)-

C13H14BrNO2

HCID612491

未命名化合物

PRODUCTS

生成物

结构：COc1cc(NC(C)CCCN2C(=O)c3ccccc3C2=O)c2ncccc2c1N(C)C

HCID618570

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-efb87e644c01476b85ad277d766ec7c5
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[Br:17][CH:18]([CH2:19][CH2:20][CH2:21][N:22]1[C:23](=[O:32])[c:24]2[c:25]([cH:28][cH:29][cH:30][cH:31]2)[C:26]1=[O:27])[CH3:33].[CH3:34][CH2:35][N:36]([CH2:37][CH3:38])[CH2:39][CH3:40].[CH3:41][C:42](=[O:43])[CH3:44].[NH2:1][c:2]1[cH:3][c:4]([O:15][CH3:16])[c:5]([N:12]([CH3:13])[CH3:14])[c:6]2[cH:7][cH:8][cH:9][n:10][c:11]12>>[NH:1]([c:2]1[cH:3][c:4]([O:15][CH3:16])[c:5]([N:12]([CH3:13])[CH3:14])[c:6]2[cH:7][cH:8][cH:9][n:10][c:11]12)[CH:18]([CH2:19][CH2:20][CH2:21][N:22]1[C:23](=[O:32])[c:24]2[c:25]([cH:28][cH:29][cH:30][cH:31]2)[C:26]1=[O:27])[CH3:33]