HRID210568

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID8857

Ethyl acetate

C4H8O2

HCID68263

1,1'-Carbonylbis(1H-imidazole)

C7H6N4O

HCID840113

2-Acetamido-1,3-thiazole-4-carboxylic acid

C6H6N2O3S

HCID58112047

未命名化合物

PRODUCTS

生成物

结构：CC(=O)Nc1nc(C(=O)Oc2ccc(CCNC(=O)NNC(=O)OC(C)(C)C)cc2)cs1

HCID86650041

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6e751af4c7ce41ebbf095d6d280de096
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:13]([n:14]1[cH:15][cH:16][n:17][cH:18]1)([n:19]1[cH:20][cH:21][n:22][cH:23]1)=[O:24].[C:1]([CH3:2])(=[O:3])[NH:4][c:5]1[s:6][cH:7][c:8]([C:10](=[O:11])[OH:12])[n:9]1.[CH3:47][CH2:48][O:49][C:50](=[O:51])[CH3:52].[OH2:46].[OH:25][c:26]1[cH:27][cH:28][c:29]([CH2:32][CH2:33][NH:34][C:35](=[O:36])[NH:37][NH:38][C:39](=[O:40])[O:41][C:42]([CH3:43])([CH3:44])[CH3:45])[cH:30][cH:31]1>>[C:1]([CH3:2])(=[O:3])[NH:4][c:5]1[s:6][cH:7][c:8]([C:10](=[O:11])[O:12][c:26]2[cH:27][cH:28][c:29]([CH2:32][CH2:33][NH:34][C:35](=[O:36])[NH:37][NH:38][C:39](=[O:40])[O:41][C:42]([CH3:43])([CH3:44])[CH3:45])[cH:30][cH:31]2)[n:9]1