Compound Identification
SMILES
CC1=CC2=C(C=C1)N=C(N=C2N[C@@H]1CCCC[C@H]1N=C(N)N)C(=O)NC1=NC=C(S1)[N+]([O-])=O
InChIKey
InChIKey=NWXKUFJOUGCGFS-ZIAGYGMSSA-N
Formula
C20H23N9O3S
Mass
469.52
Taxonomic Classification
Taxonomy Tree
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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
Pyrimidinecarboxylic acids and derivatives 2-heteroaryl carboxamides Nitroaromatic compounds Nitrothiazoles 2,5-disubstituted thiazoles Aminopyrimidines and derivatives Benzenoids Imidolactams Heteroaromatic compounds Guanidines Secondary carboxylic acid amides Propargyl-type 1,3-dipolar organic compounds Carboximidamides Azacyclic compounds Organic oxoazanium compounds Organic salts Organic zwitterions Hydrocarbon derivatives Organooxygen compounds Amines Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Quinazolinamine - Pyrimidine-2-carboxylic acid or derivatives - 2-heteroaryl carboxamide - Nitroaromatic compound - Nitrothiazole - 2,5-disubstituted 1,3-thiazole - Aminopyrimidine - Pyrimidine - Benzenoid - Imidolactam - Azole - Heteroaromatic compound - Thiazole - Carboxamide group - Guanidine - C-nitro compound - Secondary carboxylic acid amide - Organic nitro compound - Allyl-type 1,3-dipolar organic compound - Azacycle - Carboximidamide - Carboxylic acid derivative - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organic nitrogen compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic salt - Organic oxygen compound - Amine - Organic zwitterion - 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