HRID110499

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6344

Dichloromethane

CH2Cl2

HCID12291

Piperidine, 1-methyl-

C6H13N

HCID15891

Phenyl carbonochloridate

C7H5ClO2

HCID178465201

未命名化合物

PRODUCTS

生成物

结构：CC(NC(=O)C(NC(=O)Oc1ccccc1)C(C)C)c1nc2cc(Cl)ccc2s1

HCID178465216

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-703000222916448c96a599abe2cd11a1
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

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