Compound Identification
SMILES
CC1=CC(CSC2=NN=C(C(CC3=CC=CC=C3)NC(=O)NC3=CC(F)=CC=C3)N2C2=C(C)C=CC(Cl)=C2)=CC=C1
InChIKey
InChIKey=NYQWJKHASNGDQW-UHFFFAOYSA-N
Formula
C32H29ClFN5OS
Mass
586.13
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Azoles
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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
Amphetamines and derivatives N-phenylureas Toluenes Alkylarylthioethers Fluorobenzenes Chlorobenzenes Aryl chlorides Aryl fluorides Heteroaromatic compounds Ureas Sulfenyl compounds Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides Organofluorides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenyl-1,2,4-triazole - Amphetamine or derivatives - N-phenylurea - Aryl thioether - Chlorobenzene - Fluorobenzene - Halobenzene - Toluene - Alkylarylthioether - Aryl chloride - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Urea - Sulfenyl compound - Azacycle - Thioether - Organic nitrogen compound - Organohalogen compound - Organochloride - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Carbonyl group - Organofluoride - Organonitrogen compound - Organooxygen compound - Organosulfur 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