HRID97945

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6342

Acetonitrile

C2H3N

HCID8028

Tetrahydrofuran

C4H8O

HCID27833

2-Ethoxy-1-(ethoxycarbonyl)-1,2-dihydroquinoline

C14H17NO3

HCID2779087

未命名化合物

HCID58884775

ethyl N-[4-(hydrazinecarbonyl)phenyl]carbamate

C10H13N3O3

PRODUCTS

产物

HCID58884757

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-053b84d9a7f641aea53acbe0cfda70b4
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应SMILES

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