HRID297603

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID702

Ethanol

C2H6O

HCID962

Water

H2O

HCID333621

4-chloro-N,N-dimethylquinolin-7-amine

C11H11ClN2

结构：Cc1cc(Nc2ccc(NC(=O)c3ccc(N)cc3)cc2)nc(N)n1

HCID59457966

未命名化合物

PRODUCTS

生成物

HCID313

Hydrochloric Acid

ClH

结构：Cc1cc(Nc2ccc(NC(=O)c3ccc(Nc4ccnc5cc(N(C)C)ccc45)cc3)cc2)nc(N)n1

HCID24860002

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e95f8c3de0de4e629c9e2e861d7d5dcd
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[CH3:27][CH2:28][OH:29].[Cl:30][c:31]1[cH:32][cH:33][n:34][c:35]2[cH:36][c:37]([N:41]([CH3:42])[CH3:43])[cH:38][cH:39][c:40]12.[ClH:1].[NH2:2][c:3]1[cH:4][cH:5][c:6]([C:7](=[O:8])[NH:9][c:10]2[cH:11][cH:12][c:13]([NH:16][c:17]3[n:18][c:19]([NH2:24])[n:20][c:21]([CH3:23])[cH:22]3)[cH:14][cH:15]2)[cH:25][cH:26]1.[OH2:44]>>[ClH:30].[NH:2]([c:3]1[cH:4][cH:5][c:6]([C:7](=[O:8])[NH:9][c:10]2[cH:11][cH:12][c:13]([NH:16][c:17]3[n:18][c:19]([NH2:24])[n:20][c:21]([CH3:23])[cH:22]3)[cH:14][cH:15]2)[cH:25][cH:26]1)[c:31]1[cH:32][cH:33][n:34][c:35]2[cH:36][c:37]([N:41]([CH3:42])[CH3:43])[cH:38][cH:39][c:40]12