Structure Information
Structure

Compound Identification

SMILES

CC1OC[C@@H](NC2=C3SC=CC3=NC=C2[N+]([O-])=O)C=C1

InChIKey

InChIKey=UBJGEHPQPNDRNB-GKAPJAKFSA-N

Formula

C13H13N3O3S

Mass

291.33

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Thienopyridines

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Thienopyridines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Thienopyridine - Nitroaromatic compound - Aminopyridine - Secondary aliphatic/aromatic amine - Pyridine - Pyran - Thiophene - Heteroaromatic compound - C-nitro compound - Organic nitro compound - Oxacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Dialkyl ether - Ether - Secondary amine - Azacycle - Amine - Organic zwitterion - Organic salt - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as thienopyridines. These are heterocyclic compounds containing a thiophene ring fused to a pyridine ring. Thiophene is 5-membered ring consisting of four carbon atoms and one sulfur atom. Pyridine is a 6-membered ring consisting of five carbon atoms and one nitrogen center.

External Descriptors

Not available

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