Structure Information
Structure

Compound Identification

SMILES

CC1=CC=C(C=C1)N1C(=O)C2=C(SC3=C2CCCC3)N=C1SCC(=O)NC1=CC=C(C=C1)[N+]([O-])=O

InChIKey

InChIKey=ZSMZCTAZZXWTGI-UHFFFAOYSA-N

Formula

C25H22N4O4S2

Mass

506.6

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 - Anilide - Nitrobenzene - N-arylamide - Nitroaromatic compound - Aryl thioether - Alkylarylthioether - Pyrimidone - Toluene - Pyrimidine - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Thiophene - Carboxamide group - Lactam - C-nitro compound - Organic nitro compound - Secondary carboxylic acid amide - Carboxylic acid derivative - Azacycle - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Thioether - Sulfenyl compound - Organooxygen compound - Organonitrogen compound - Carbonyl group - Organosulfur compound - Organic salt - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic zwitterion - Organic nitrogen 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