Structure Information
Structure

Compound Identification

SMILES

Cl.[O-][N+](=O)O[C@H]1CO[C@@H]2[C@H](CO[C@H]12)N1CCN(CCCSC2=CC=CC=C2)CC1

InChIKey

InChIKey=BSBYHJLFVULNJK-DVZYSVAJSA-N

Formula

C19H28ClN3O5S

Mass

445.96

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Furofurans

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Furofurans

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Aryl thioether - Furofuran - Thiophenol ether - Alkylarylthioether - N-alkylpiperazine - Monocyclic benzene moiety - 1,4-diazinane - Piperazine - Benzenoid - Organic nitrate - Oxolane - Alkyl nitrate - Organic nitric acid or derivatives - Organic nitro compound - Tertiary amine - Tertiary aliphatic amine - Dialkyl ether - Ether - Oxacycle - Azacycle - Thioether - Organic 1,3-dipolar compound - Sulfenyl compound - Allyl-type 1,3-dipolar organic compound - Organic nitrogen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Amine - Hydrochloride - Organic oxygen compound - Organic salt - Organopnictogen compound - Organic oxide - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as furofurans. These are organic compounds containing a two furan rings fused to each other. Furan is a five-membered aromatic ring with four carbon atoms and one oxygen atom.

External Descriptors

Not available

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