HRID1545164

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID6885

Phthalide

C8H6O2

HCID31297

Methanesulfonyl chloride

CH3ClO2S

HCID81531

Diisopropylethylamine

C8H19N

HCID16682925

Aluminum, trimethyl-

C3H9Al

结构：Cc1ccc2c(N3CCN(CCc4cccc(N)c4)CC3)cccc2n1

HCID49852105

未命名化合物

PRODUCTS

生成物

结构：Cc1ccc2c(N3CCN(CCc4cccc(N5Cc6ccccc6C5=O)c4)CC3)cccc2n1

HCID57478353

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a0294bb7aff24554bb83627d23f47c66
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

[C:31]1(=[O:32])[O:33][CH2:34][c:35]2[cH:36][cH:37][cH:38][cH:39][c:40]21.[CH3:1][Al:2]([CH3:3])[CH3:4].[CH3:50][S:51](=[O:52])(=[O:53])[Cl:54].[CH3:5][c:6]1[n:7][c:8]2[cH:9][cH:10][cH:11][c:12]([N:16]3[CH2:17][CH2:18][N:19]([CH2:22][CH2:23][c:24]4[cH:25][c:26]([NH2:27])[cH:28][cH:29][cH:30]4)[CH2:20][CH2:21]3)[c:13]2[cH:14][cH:15]1.[CH:41]([N:42]([CH2:43][CH3:44])[CH:45]([CH3:46])[CH3:47])([CH3:48])[CH3:49].[Cl:55][CH2:56][Cl:57]>>[CH3:5][c:6]1[n:7][c:8]2[cH:9][cH:10][cH:11][c:12]([N:16]3[CH2:17][CH2:18][N:19]([CH2:22][CH2:23][c:24]4[cH:25][c:26]([N:27]5[C:31](=[O:32])[c:40]6[c:35]([cH:36][cH:37][cH:38][cH:39]6)[CH2:34]5)[cH:28][cH:29][cH:30]4)[CH2:20][CH2:21]3)[c:13]2[cH:14][cH:15]1