Structure Information
Structure

Compound Identification

SMILES

COC1=C(OC)C(OC)=C(C=C1)C1N2NC(SCC3=CC=C(C=C3)[N+]([O-])=O)=NC2=NC2=C1C(=O)CC(C)(C)C2

InChIKey

InChIKey=ZHYCASLDOJMKSI-UHFFFAOYSA-N

Formula

C27H29N5O6S

Mass

551.62

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Diazanaphthalenes

Subclass

Benzodiazines

Intermediate Tree Nodes

Not available

Direct Parent

Quinazolines

Alternative Parents

Nitrobenzenes Phenoxy compounds Anisoles Nitroaromatic compounds Methoxybenzenes Alkyl aryl ethers Cyclohexenones Hydropyrimidines Triazolines Sulfenyl compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Azacyclic compounds Hydrocarbon derivatives Imines Organic oxides Organic salts Organic zwitterions

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Quinazoline - Nitrobenzene - Phenoxy compound - Nitroaromatic compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - Cyclohexenone - Monocyclic benzene moiety - Hydropyrimidine - 1,6-dihydropyrimidine - Benzenoid - Triazoline - Ketone - Organic nitro compound - C-nitro compound - Ether - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Sulfenyl compound - Organic oxide - Organic salt - Imine - Organic oxygen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Organic zwitterion - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as quinazolines. These are compounds containing a quinazoline moiety, which is made up of two fused six-member aromatic rings, a benzene ring and a pyrimidine ring.

External Descriptors

Not available

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