Compound Identification
SMILES
O=C(NC(=O)C1=CC=CC=C1)NC1=NC2=CC=CC=C2N2C(=O)N(N=C12)C1=CC=CC=C1
InChIKey
InChIKey=TXXMXNKTAHMIAM-UHFFFAOYSA-N
Formula
C23H16N6O3
Mass
424.42
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Azoles
-
Subclass
Triazoles
-
Level 5
Triazolones
- Level 6 Aryl 1,2,4-triazolones
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Level 5
Triazolones
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Subclass
Triazoles
-
Class
Azoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azoles
Subclass
Triazoles
Intermediate Tree Nodes
Triazolones
Direct Parent
Aryl 1,2,4-triazolones
Alternative Parents
Phenyl-1,2,4-triazoles Quinoxalines Benzoic acids and derivatives Benzoyl derivatives Pyrazines Imidolactams Heteroaromatic compounds Ureas Carboxylic acids and derivatives Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Aryl 1,2,4-triazol-3-one - Phenyltriazole - Phenyl-1,2,4-triazole - Diazanaphthalene - Quinoxaline - Benzoic acid or derivatives - Benzoyl - Monocyclic benzene moiety - Pyrazine - Imidolactam - Benzenoid - Heteroaromatic compound - Carbonic acid derivative - Urea - Carboxylic acid derivative - Azacycle - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Carbonyl group - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as aryl 1,2,4-triazolones. These are aromatic heterocyclic compounds containing a 1,2,4-triazolone moiety that is substituted at the 5-position with an aryl group.
External Descriptors
Not available