Compound Identification
SMILES
CC1=C(COC(=O)C2=CC=CC=C2OS(O)(=O)=O)C=CC2=C1C(N)=NC(N)=N2
InChIKey
InChIKey=JBXFJOKLNLWPGN-UHFFFAOYSA-N
Formula
C17H16N4O6S
Mass
404.4
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Diazanaphthalenes
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Subclass
Benzodiazines
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Level 5
Quinazolines
- Level 6 Quinazolinamines
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Level 5
Quinazolines
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Subclass
Benzodiazines
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Class
Diazanaphthalenes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazanaphthalenes
Subclass
Benzodiazines
Intermediate Tree Nodes
Quinazolines
Direct Parent
Quinazolinamines
Alternative Parents
Phenylsulfates Benzoic acid esters Phenoxy compounds Benzoyl derivatives Aminopyrimidines and derivatives Sulfuric acid monoesters Imidolactams Heteroaromatic compounds Carboxylic acid esters Amino acids and derivatives Azacyclic compounds Primary amines Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylsulfate - Quinazolinamine - Benzoate ester - Arylsulfate - Benzoic acid or derivatives - Phenoxy compound - Benzoyl - Aminopyrimidine - Monocyclic benzene moiety - Pyrimidine - Sulfuric acid monoester - Sulfate-ester - Sulfuric acid ester - Benzenoid - Imidolactam - Heteroaromatic compound - Organic sulfuric acid or derivatives - Carboxylic acid ester - Amino acid or derivatives - Carboxylic acid derivative - Azacycle - Primary amine - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Amine - Organic oxygen compound - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as quinazolinamines. These are heterocyclic aromatic compounds containing a quianazoline moiety substituted by one or more amine groups.
External Descriptors
Not available