Compound Identification
SMILES
CC1=C(C=C(Cl)C=C1)N1C(CNC(=O)NC2=CC=C(C=C2)C(F)(F)F)=NN=C1SCC1=CC=C(F)C=C1
InChIKey
InChIKey=ZEDCQUYOFGBGAJ-UHFFFAOYSA-N
Formula
C25H20ClF4N5OS
Mass
549.97
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Azoles
-
Subclass
Triazoles
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Level 5
Phenyltriazoles
- Level 6 Phenyl-1,2,4-triazoles
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Level 5
Phenyltriazoles
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Subclass
Triazoles
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Class
Azoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azoles
Subclass
Triazoles
Intermediate Tree Nodes
Phenyltriazoles
Direct Parent
Phenyl-1,2,4-triazoles
Alternative Parents
Trifluoromethylbenzenes N-phenylureas Toluenes Alkylarylthioethers Chlorobenzenes Fluorobenzenes Aryl chlorides Aryl fluorides Heteroaromatic compounds Ureas Sulfenyl compounds Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organochlorides Organofluorides Organonitrogen compounds Alkyl fluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenyl-1,2,4-triazole - N-phenylurea - Trifluoromethylbenzene - Aryl thioether - Chlorobenzene - Fluorobenzene - Halobenzene - Toluene - Alkylarylthioether - Benzenoid - Aryl fluoride - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Heteroaromatic compound - Urea - Azacycle - Sulfenyl compound - Thioether - Organochloride - Organohalogen compound - Organic nitrogen compound - Alkyl halide - Alkyl fluoride - Carbonyl group - Organosulfur compound - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Organofluoride - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenyl-1,2,4-triazoles. These are organic compounds containing a 1,2,4-triazole substituted by a phenyl group.
External Descriptors
Not available