HRID2322922

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID222

Ammonia gas

H3N

HCID241

Benzene

C6H6

HCID313

Hydrochloric Acid

ClH

2 次

HCID702

Ethanol

C2H6O

HCID887

Methanol

CH4O

HCID609608

4-Cyanostilbene

C15H11N

HCID21972543

未命名化合物

HCID53828711

未命名化合物

PRODUCTS

生成物

HCID313

Hydrochloric Acid

ClH

HCID54050356

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-851664172fec4035bd4fa33aa5f02c04
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

[C:2](#[N:3])[c:4]1[cH:5][cH:6][c:7]([CH:10]=[CH:11][c:12]2[cH:13][cH:14][cH:15][cH:16][cH:17]2)[cH:8][cH:9]1.[C:38](=[NH:39])([O-:40])[c:41]1[cH:42][cH:43][cH:44][cH:45][cH:46]1.[CH2:19]([O:20][C:21]([c:22]1[cH:23][cH:24][c:25]([CH:26]=[CH:27][c:28]2[cH:29][cH:30][cH:31][cH:32][cH:33]2)[cH:34][cH:35]1)=[NH:37])[CH3:36].[CH3:48][OH:49].[CH3:50][CH2:51][OH:52].[ClH:18].[ClH:1].[NH3:47].[cH:53]1[cH:54][cH:55][cH:56][cH:57][cH:58]1>>[C:2](=[NH:3])([c:4]1[cH:5][cH:6][c:7]([CH:10]=[CH:11][c:12]2[cH:13][cH:14][cH:15][cH:16][cH:17]2)[cH:8][cH:9]1)[NH2:37].[ClH:1]