Compound Identification
SMILES
CC1=CC(CSC2=NN=C(C(CC3=CC=CC=C3)NS(=O)(=O)C3=CC=C(F)C=C3)N2C2=C(C)C=CC(Cl)=C2)=CC=C1
InChIKey
InChIKey=ISMBZAKHUPFRPQ-UHFFFAOYSA-N
Formula
C31H28ClFN4O2S2
Mass
607.16
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
Amphetamines and derivatives Benzenesulfonamides Benzenesulfonyl compounds Toluenes Alkylarylthioethers Chlorobenzenes Fluorobenzenes Organosulfonamides Aryl chlorides Aryl fluorides Aminosulfonyl compounds Heteroaromatic compounds Azacyclic compounds Sulfenyl compounds Organochlorides Organofluorides Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenyl-1,2,4-triazole - Amphetamine or derivatives - Benzenesulfonamide - Benzenesulfonyl group - Aryl thioether - Chlorobenzene - Fluorobenzene - Halobenzene - Toluene - Alkylarylthioether - Aryl fluoride - Organosulfonic acid amide - Aryl halide - Benzenoid - Monocyclic benzene moiety - Aryl chloride - Heteroaromatic compound - Aminosulfonyl compound - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Sulfenyl compound - Thioether - Azacycle - Hydrocarbon derivative - Organohalogen compound - Organic nitrogen compound - Organic oxygen compound - Organochloride - Organofluoride - Organonitrogen compound - Organosulfur compound - Organic oxide - 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