Structure Information
Structure

Compound Identification

SMILES

CN1C=C(C(=O)NCC2=CC=C(Br)C=C2)C(=O)C2=C1SC(CN1CCOCC1)=C2

InChIKey

InChIKey=UPWPLJLBGOEQEY-UHFFFAOYSA-N

Formula

C21H22BrN3O3S

Mass

476.39

Export to:

JSON SDF CSV

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

Pyridinecarboxamide - Pyridine carboxylic acid or derivatives - Thienopyridine - 2,3,5-trisubstituted thiophene - Bromobenzene - Halobenzene - Aralkylamine - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Morpholine - Oxazinane - Pyridine - Benzenoid - Vinylogous amide - Thiophene - Heteroaromatic compound - Tertiary amine - Secondary carboxylic acid amide - Amino acid or derivatives - Tertiary aliphatic amine - Carboxamide group - Azacycle - Oxacycle - Carboxylic acid derivative - Dialkyl ether - Ether - Hydrocarbon derivative - Organic oxygen compound - Amine - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Organic oxide - 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

Previous Back Next