Structure Information
Structure

Compound Identification

SMILES

OC(=O)\C=C/C(O)=O.CN1CC(C2=C(C1)SC(CN1CCOCC1)=C2)C1=CC=C(Cl)C=C1

InChIKey

InChIKey=YYBULXCRPHXDPQ-BTJKTKAUSA-N

Formula

C23H27ClN2O5S

Mass

478.99

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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

Not available

Substituents

Thienopyridine - 2,3,5-trisubstituted thiophene - Chlorobenzene - Halobenzene - Aralkylamine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Morpholine - Oxazinane - Unsaturated fatty acid - Benzenoid - Fatty acid - Fatty acyl - Thiophene - Heteroaromatic compound - Tertiary amine - Tertiary aliphatic amine - Oxacycle - Azacycle - Dialkyl ether - Carboxylic acid - Carboxylic acid derivative - Ether - Organopnictogen compound - Organic oxygen compound - Amine - Organohalogen compound - Organic oxide - Organochloride - Hydrocarbon derivative - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Carbonyl group - 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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