Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=C(C)N=C(NC(=O)CSC2=NC=NC3=C2C(=CS3)C2=CC=C(F)C=C2)S1

InChIKey

InChIKey=CIRKGDRGASXJDH-UHFFFAOYSA-N

Formula

C20H15FN4O3S3

Mass

474.54

Export to:

JSON SDF CSV

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 - 2,4,5-trisubstituted 1,3-thiazole - Aryl thioether - Thiazolecarboxylic acid or derivatives - N-arylamide - Halobenzene - Fluorobenzene - Alkylarylthioether - Pyrimidine - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Thiophene - Heteroaromatic compound - Thiazole - Methyl ester - Azole - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Thioether - Sulfenyl compound - Carboxylic acid derivative - Azacycle - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organosulfur compound - Organic oxygen compound - 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

Previous Back Next