HRID1574731

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID312

Chloride

Cl-

HCID769

Bicarbonate Ion

CHO3-

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID6344

Dichloromethane

CH2Cl2

HCID8028

Tetrahydrofuran

C4H8O

HCID8471

Triethylamine

C6H15N

HCID24819

Phosphorus pentachloride

Cl5P

HCID14230519

未命名化合物

结构：CC(C)(ON=C(C(=O)O)c1csc(NC(=O)CCl)n1)C(=O)OCC[Si](C)(C)C

HCID53696521

未命名化合物

PRODUCTS

生成物

结构：COC(=O)C1NC(=O)C1NC(=O)C(=NOC(C)(C)C(=O)OCC[Si](C)(C)C)c1csc(NC(=O)CCl)n1

HCID54334648

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a8709571a9df48c78f0ec78adad4f081
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

[C:46](=[O:47])([O-:48])[OH:49].[CH2:51]([Cl:52])[Cl:53].[CH3:60][CH2:61][N:62]([CH2:63][CH3:64])[CH2:65][CH3:66].[Cl-:35].[Cl:1][CH2:2][C:3](=[O:4])[NH:5][c:6]1[s:7][cH:8][c:9]([C:11]([C:12](=[O:13])[OH:14])=[N:15][O:16][C:17]([CH3:18])([C:19](=[O:20])[O:21][CH2:22][CH2:23][Si:24]([CH3:25])([CH3:26])[CH3:27])[CH3:28])[n:10]1.[Cl:29][P:30]([Cl:31])([Cl:32])([Cl:33])[Cl:34].[NH2:36][CH:37]1[C:38](=[O:45])[NH:39][CH:40]1[C:41](=[O:42])[O:43][CH3:44].[Na+:50].[O:54]1[CH2:55][CH2:56][CH2:57][CH2:58]1.[OH2:59]>>[Cl:1][CH2:2][C:3](=[O:4])[NH:5][c:6]1[s:7][cH:8][c:9]([C:11]([C:12](=[O:13])[NH:36][CH:37]2[C:38](=[O:45])[NH:39][CH:40]2[C:41](=[O:42])[O:43][CH3:44])=[N:15][O:16][C:17]([CH3:18])([C:19](=[O:20])[O:21][CH2:22][CH2:23][Si:24]([CH3:25])([CH3:26])[CH3:27])[CH3:28])[n:10]1