Structure Information
Structure

Compound Identification

SMILES

CCCOP(=S)(OCCC)SCC(=O)OC(N1C=NC=N1)C(=O)C(C)(C)C

InChIKey

InChIKey=HMPVDZFAUYNIPR-UHFFFAOYSA-N

Formula

C16H28N3O5PS2

Mass

437.51

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic oxygen compounds

Class

Organooxygen compounds

Subclass

Carbonyl compounds

Intermediate Tree Nodes

Alpha-acyloxy carbonyl compounds

Direct Parent

Alpha-acyloxy ketones

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Alpha-acyloxy ketone - Dithiophosphate o-ester - Dithiophosphate s-ester - Azole - Heteroaromatic compound - 1,2,4-triazole - Organic dithiophosphate - Carboxylic acid ester - Ketone - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organothiophosphorus compound - Azacycle - Sulfenyl compound - Organoheterocyclic compound - Organonitrogen compound - Organosulfur compound - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as alpha-acyloxy ketones. These are ketones that have an acyloxy substituent alpha to the carbonyl group. They have the general structure R4C(=O)OC(R2)(R3)C(R1)=O (R1=organyl, R4=H or organyl; R2,R3 = any atom).

External Descriptors

Not available

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