HRID1202292

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6422

未命名化合物

HCID8471

Triethylamine

C6H15N

结构：CCC1C(NC(=O)C(=NOC(C)(C)C(=O)OC(C)(C)C)c2csc(N)n2)C(=O)N1S(=O)(=O)O

HCID178437165

未命名化合物

PRODUCTS

生成物

HCID8471

Triethylamine

C6H15N

结构：CCC1C(NC(=O)C(=NOC(C)(C)C(=O)O)c2csc(N)n2)C(=O)N1S(=O)(=O)O

HCID76065990

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-90eb38c6413f466c8090403f3c96fd63
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

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