HRID281437

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID996

Phenol

C6H6O

HCID3283

Diethyl Ether

C4H10O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID7914

Isopropyl ether

C6H14O

HCID166653

Hydride

H-

结构：COc1ccc2c(Cc3c(Cl)cncc3Cl)nnc(Cl)c2c1

HCID18629210

4-Chloro-1-[(3,5-dichloropyridin-4-yl)methyl]-6-methoxyphthalazine

C15H10Cl3N3O

PRODUCTS

生成物

结构：COc1ccc2c(Cc3c(Cl)cncc3Cl)nnc(Oc3ccccc3)c2c1

HCID18332459

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-534d2067d52543c69dd7cdc4d1f6030f
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

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