Structure Information
Structure

Compound Identification

SMILES

COC1=CC=C(C=C1)[C@H](CNC(=O)CSC1=NC=NC2=C1SC=C2)[NH+]1CCCCC1

InChIKey

InChIKey=VCYQUAVUZAPKJQ-IBGZPJMESA-O

Formula

C22H27N4O2S2

Mass

443.6

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Thienopyrimidines

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Thienopyrimidines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Thienopyrimidine - Anisole - Phenoxy compound - Aryl thioether - Phenol ether - Methoxybenzene - Alkyl aryl ether - Alkylarylthioether - Aralkylamine - Monocyclic benzene moiety - Piperidine - Benzenoid - Pyrimidine - Heteroaromatic compound - Quaternary ammonium salt - Thiophene - Secondary carboxylic acid amide - Tertiary aliphatic amine - Carboxamide group - Thioether - Sulfenyl compound - Azacycle - Carboxylic acid derivative - Ether - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organosulfur compound - Organic oxygen compound - Amine - Carbonyl group - Organic nitrogen compound - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as thienopyrimidines. These are heterocyclic compounds containing a thiophene ring fused to a pyrimidine ring. Thiophene is 5-membered ring consisting of four carbon atoms and one sulfur atom. Pyrimidine is a 6-membered ring consisting of four carbon atoms and two nitrogen centers at the 1- and 3- ring positions.

External Descriptors

Not available

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