Compound Identification
SMILES
COC(=O)C1CCN(CC2=C3N(C=C2)N=CN=C3NC2=CC3=C(C=C2)N(CC2=CC(F)=CC=C2)N=C3)CC1
InChIKey
InChIKey=QHGVESLEXVDJPY-UHFFFAOYSA-N
Formula
C28H28FN7O2
Mass
513.577
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Benzopyrazoles
- Subclass Indazoles
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Class
Benzopyrazoles
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzopyrazoles
Subclass
Indazoles
Intermediate Tree Nodes
Not available
Direct Parent
Indazoles
Alternative Parents
Pyrrolo[2,1-f][1,2,4]triazines Piperidinecarboxylic acids Aralkylamines Fluorobenzenes 1,2,4-triazines Substituted pyrroles Aryl fluorides Imidolactams Pyrazoles Heteroaromatic compounds Methyl esters Amino acids and derivatives Trialkylamines Azacyclic compounds Secondary amines Monocarboxylic acids and derivatives Hydrocarbon derivatives Organofluorides Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzopyrazole - Pyrrolo[2,1-f][1,2,4]triazine - Indazole - Piperidinecarboxylic acid - Fluorobenzene - Halobenzene - Aralkylamine - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Piperidine - Substituted pyrrole - Triazine - Benzenoid - Imidolactam - 1,2,4-triazine - Pyrrole - Pyrazole - Heteroaromatic compound - Methyl ester - Azole - Tertiary aliphatic amine - Tertiary amine - Amino acid or derivatives - Carboxylic acid ester - Secondary amine - Azacycle - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Carbonyl group - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as indazoles. These are compounds containing an indazole, which is structurally characterized by a pyrazole fused to a benzene.
External Descriptors
Not available