Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=C(N(N=N1)[C@@H]1CC[C@@H]2[C@H](Cl)CCC1S2=O)C(=O)OC

InChIKey

InChIKey=CEKVOBKJCKTYJZ-AAOCPJHKSA-N

Formula

C14H18ClN3O5S

Mass

375.82

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Thianes

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Thianes

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Thiane - Azole - 1,2,3-triazole - Methyl ester - Heteroaromatic compound - Vinylogous amide - Carboxylic acid ester - Sulfoxide - Sulfinyl compound - Carboxylic acid derivative - Azacycle - Organic oxide - Organic oxygen compound - Alkyl halide - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Alkyl chloride - Organic nitrogen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as thianes. These are heterocyclic compounds containing a saturated six-member ring with five carbon atoms and one sulfur atom.

External Descriptors

Not available

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