HRID98347

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11

1,2-Dichloroethane

C2H4Cl2

HCID679

Dimethyl sulfoxide

C2H6OS

HCID962

Water

H2O

HCID6597

Dichloroacetic acid

C2H2Cl2O2

HCID8857

Ethyl Acetate

C4H8O2

HCID77157403

未命名化合物

PRODUCTS

产物

HCID49785185

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-cd735280f9ef4273ada56728cf089c10
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应SMILES

[CH2:1]([Cl:2])[CH2:3][Cl:4].[CH3:40][CH2:41][O:42][C:43](=[O:44])[CH3:45].[CH3:46][S:47]([CH3:48])=[O:49].[Cl:5][CH:6]([Cl:7])[C:8]([OH:9])=[O:10].[NH2:11][C:12]([CH:13]([CH:14]([CH2:15][c:16]1[cH:17][cH:18][cH:19][cH:20][cH:21]1)[NH:22][C:23](=[O:24])[CH:25]1[N:26]([CH2:31][c:32]2[cH:33][cH:34][cH:35][cH:36][cH:37]2)[C:27](=[O:30])[CH2:28][CH2:29]1)[OH:38])=[O:39].[OH2:50]>>[NH2:11][C:12]([C:13]([CH:14]([CH2:15][c:16]1[cH:17][cH:18][cH:19][cH:20][cH:21]1)[NH:22][C:23](=[O:24])[CH:25]1[N:26]([CH2:31][c:32]2[cH:33][cH:34][cH:35][cH:36][cH:37]2)[C:27](=[O:30])[CH2:28][CH2:29]1)=[O:38])=[O:39]