HRID1240836

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID679

Dimethyl sulfoxide

C2H6OS

HCID962

Water

H2O

HCID8857

Ethyl acetate

C4H8O2

HCID651148

phenyl N-(1,3-thiazol-2-yl)carbamate

C10H8N2O2S

反应SMILES：COc1cc2nccc(Sc3ccc(N)s3)c2cc1C(N)=O

HCID22936269

未命名化合物

PRODUCTS

产物

反应SMILES：COc1cc2nccc(Sc3ccc(NC(=O)Nc4nccs4)s3)c2cc1C(N)=O

HCID22936869

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-f61780bfbb0d450cb82ddd160de1a9c0
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应SMILES

[CH3:38][CH2:39][O:40][C:41](=[O:42])[CH3:43].[CH3:45][S:46]([CH3:47])=[O:48].[NH2:1][c:2]1[cH:3][cH:4][c:5]([S:7][c:8]2[cH:9][cH:10][n:11][c:12]3[cH:13][c:14]([O:21][CH3:22])[c:15]([C:18](=[O:19])[NH2:20])[cH:16][c:17]23)[s:6]1.[OH2:44].[c:23]1([O:29][C:30](=[O:24])[NH:31][c:32]2[s:33][cH:34][cH:35][n:36]2)[cH:25][cH:26][cH:27][cH:28][cH:37]1>>[NH:1]([c:2]1[cH:3][cH:4][c:5]([S:7][c:8]2[cH:9][cH:10][n:11][c:12]3[cH:13][c:14]([O:21][CH3:22])[c:15]([C:18](=[O:19])[NH2:20])[cH:16][c:17]23)[s:6]1)[C:30](=[O:29])[NH:31][c:32]1[s:33][cH:34][cH:35][n:36]1