HRID2337998

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1049

Pyridine

C5H5N

HCID6344

Dichloromethane

CH2Cl2

HCID8857

Ethyl acetate

C4H8O2

HCID86588198

未命名化合物

反应SMILES：COC(=O)c1ccc(S(=O)(=O)Cl)c(OCc2ccccc2)c1

HCID86588224

未命名化合物

PRODUCTS

产物

反应SMILES：COC(=O)c1ccc(S(=O)(=O)NC(CC(=O)OC(C)(C)C)C(=O)N(C)OC)c(OCc2ccccc2)c1

HCID87967171

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-93d32f7711574ec4bc7bb8e9518a5e3f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应SMILES

[C:23]([CH3:24])([CH3:25])([CH3:26])[O:27][C:28]([CH2:29][CH:30]([C:31](=[O:32])[N:33]([CH3:34])[O:35][CH3:36])[NH2:37])=[O:38].[CH3:1][O:2][C:3]([c:4]1[cH:5][c:6]([O:14][CH2:15][c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[c:7]([S:10](=[O:11])(=[O:12])[Cl:13])[cH:8][cH:9]1)=[O:22].[CH3:48][CH2:49][O:50][C:51](=[O:52])[CH3:53].[Cl:45][CH2:46][Cl:47].[cH:39]1[cH:40][cH:41][n:42][cH:43][cH:44]1>>[CH3:1][O:2][C:3]([c:4]1[cH:5][c:6]([O:14][CH2:15][c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[c:7]([S:10](=[O:11])(=[O:12])[NH:37][CH:30]([CH2:29][C:28]([O:27][C:23]([CH3:24])([CH3:25])[CH3:26])=[O:38])[C:31](=[O:32])[N:33]([CH3:34])[O:35][CH3:36])[cH:8][cH:9]1)=[O:22]