HRID211534

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID2757378

4-(4-Carboxyphenyl)-3-thiosemicarbazide

C8H9N3O2S

HCID44207289

未命名化合物

PRODUCTS

生成物

结构：CC(=NNC(=S)Nc1ccc(C(=O)O)cc1)c1csc(-c2ccc(C(C)(C)C)cc2)c1O

HCID72359949

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-892e4340828c4047a8695897611f649e
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

[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][cH:7][c:8](-[c:11]2[s:12][cH:13][c:14]([C:17](=[O:18])[CH3:19])[c:15]2[OH:16])[cH:9][cH:10]1.[CH3:35][N:36]([CH3:37])[CH:38]=[O:39].[ClH:34].[NH:20]([NH2:21])[C:22](=[S:23])[NH:24][c:25]1[cH:26][cH:27][c:28]([C:29](=[O:30])[OH:31])[cH:32][cH:33]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][cH:7][c:8](-[c:11]2[s:12][cH:13][c:14]([C:17]([CH3:19])=[N:21][NH:20][C:22](=[S:23])[NH:24][c:25]3[cH:26][cH:27][c:28]([C:29](=[O:30])[OH:31])[cH:32][cH:33]3)[c:15]2[OH:16])[cH:9][cH:10]1