HRID1135018

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID223

Ammonia ion (NH4+)

H4N+

HCID313

Hydrochloric Acid

ClH

HCID961

Hydroxide

HO-

HCID6212

Chloroform

CHCl3

HCID6344

Dichloromethane

CH2Cl2

HCID6422

未命名化合物

HCID12052

Silane, triethyl-

C6H16Si

HCID70624

4-Chlorophenylhydrazine

C6H7ClN2

HCID68800060

未命名化合物

PRODUCTS

生成物

结构：CC1CN(CC=Cc2ccc(Cl)cc2)CCC12CNc1ccc(Cl)cc12

HCID68799649

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-504357b43954454eaf56b1a533dfc8ae
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

[CH2:38]([SiH:39]([CH2:40][CH3:41])[CH2:42][CH3:43])[CH3:44].[CH:47]([Cl:48])([Cl:49])[Cl:50].[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH:6]=[CH:7][CH2:8][N:9]2[CH2:10][CH:11]([CH3:18])[C:12](=[CH:15][O:16][CH3:17])[CH2:13][CH2:14]2)[cH:19][cH:20]1.[Cl:22][c:23]1[cH:24][cH:25][c:26]([NH:29][NH2:30])[cH:27][cH:28]1.[Cl:51][CH2:52][Cl:53].[ClH:21].[NH4+:45].[OH-:46].[OH:31][C:32]([C:33]([F:34])([F:35])[F:36])=[O:37]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH:6]=[CH:7][CH2:8][N:9]2[CH2:10][CH:11]([CH3:18])[C:12]3([CH2:13][CH2:14]2)[CH2:15][NH:29][c:26]2[cH:25][cH:24][c:23]([Cl:22])[cH:28][c:27]23)[cH:19][cH:20]1