Structure Information
Structure

Compound Identification

SMILES

CC1=NC2=C(C=C(C=C2)S(=O)(=O)NC2=C(Cl)C=C(C=C2Cl)[N+]([O-])=O)C(=O)N1N1C(=O)C(=CC2=CC=CC=C2S)N=C1C1=CC=CC=C1

InChIKey

InChIKey=GWOOTMQRZOSZNI-UHFFFAOYSA-N

Formula

C31H20Cl2N6O6S2

Mass

707.56

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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

Alpha amino acids and derivatives Sulfanilides Nitrobenzenes Thiophenols Dichlorobenzenes Nitroaromatic compounds Pyrimidones Organosulfonamides Aryl chlorides Imidazolinones Heteroaromatic compounds Aminosulfonyl compounds Amidrazones Lactams Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Organochlorides Organic salts Carbonyl compounds Organonitrogen compounds Organic zwitterions Hydrocarbon derivatives Organic oxides Thiols

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Alpha-amino acid or derivatives - Quinazoline - Sulfanilide - Nitrobenzene - Nitroaromatic compound - 1,3-dichlorobenzene - Thiophenol - Chlorobenzene - Halobenzene - Pyrimidone - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Imidazolinone - Pyrimidine - Organosulfonic acid amide - Benzenoid - Sulfonyl - Aminosulfonyl compound - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - 2-imidazoline - Heteroaromatic compound - Lactam - C-nitro compound - Organic nitro compound - Carboxylic acid amidrazone - Azacycle - Organic 1,3-dipolar compound - Organic oxoazanium - Arylthiol - Carboxylic acid derivative - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organonitrogen compound - Organic nitrogen compound - Organic salt - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Carbonyl group - Organohalogen compound - Organochloride - Organooxygen compound - Organosulfur compound - Organic zwitterion - 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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