HRID211448

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID68242

2-Furancarbonyl chloride

C5H3ClO2

结构：O=C(O)C(=NO)c1csc(NC(c2ccccc2)(c2ccccc2)c2ccccc2)n1

HCID73078134

未命名化合物

PRODUCTS

生成物

结构：O=C(O)C(=NOC(=O)c1ccco1)c1csc(NC(c2ccccc2)(c2ccccc2)c2ccccc2)n1

HCID54089519

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f929cb565870482c840fe144ee771e76
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

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