Compound Identification
SMILES
FC1=C(C(Cl)=C(C=C1)C(=O)N1[C@@H]2CC[C@H]1C1=NN=C(N1C2)C1=CC=CC=N1)C(F)(F)F
InChIKey
InChIKey=XOBAFBCJBBPMMO-YGRLFVJLSA-N
Formula
C20H14ClF4N5O
Mass
451.81
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Pyridines and derivatives
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Subclass
Pyridyltriazoles
- Level 5 Pyridyl-1,2,4-triazoles
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Subclass
Pyridyltriazoles
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Class
Pyridines and derivatives
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyridines and derivatives
Subclass
Pyridyltriazoles
Intermediate Tree Nodes
Not available
Direct Parent
Pyridyl-1,2,4-triazoles
Alternative Parents
Trifluoromethylbenzenes 2-halobenzoic acids and derivatives 4-halobenzoic acids and derivatives Benzamides Triazolopyrazines Benzoyl derivatives N-acylpyrrolidines Chlorobenzenes Fluorobenzenes Azepines Pyrazines Aryl chlorides Aryl fluorides Vinylogous halides Heteroaromatic compounds Tertiary carboxylic acid amides Triazoles Azacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides Organofluorides Alkyl fluorides Organonitrogen compounds Organooxygen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyridyl-1,2,4-triazole - 2-halobenzoic acid or derivatives - 4-halobenzoic acid or derivatives - Trifluoromethylbenzene - Halobenzoic acid or derivatives - Benzamide - Benzoic acid or derivatives - Triazolopyrazine - Benzoyl - N-acylpyrrolidine - Azepine - Chlorobenzene - Fluorobenzene - Halobenzene - Benzenoid - Aryl chloride - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Pyrazine - Heteroaromatic compound - Vinylogous halide - Azole - 1,2,4-triazole - Triazole - Tertiary carboxylic acid amide - Pyrrolidine - Carboxamide group - Carboxylic acid derivative - Azacycle - Organic oxide - Hydrocarbon derivative - Alkyl halide - Alkyl fluoride - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organohalogen compound - Organochloride - Organofluoride - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyridyl-1,2,4-triazoles. These are organic compounds containing a pyridine ring attached to a 1,2,4-triazole ring.
External Descriptors
Not available