Structure Information
Structure

Compound Identification

SMILES

CC1=C(C)C2=C(NC(NC2=O)C=CC2=CC(=CC=C2)[N+]([O-])=O)S1

InChIKey

InChIKey=NIPATHWLUADOQU-UHFFFAOYSA-N

Formula

C16H15N3O3S

Mass

329.37

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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

Nitrobenzene - Thienopyrimidine - 3,4,5-trisubstituted-2-aminothiophene - Nitroaromatic compound - Styrene - Monocyclic benzene moiety - Benzenoid - 2-aminothiophene - Heteroaromatic compound - Thiophene - Vinylogous amide - Carboxamide group - Lactam - C-nitro compound - Secondary carboxylic acid amide - Organic nitro compound - Azacycle - Organic oxoazanium - Carboxylic acid derivative - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic zwitterion - Hydrocarbon derivative - Organic oxide - Amine - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Organic salt - 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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