Compound Identification
SMILES
C[C@@H](NC(=O)CSC1=NN=C([C@H](C)[NH+]2CCCCC2)N1C1=CC=C(F)C=C1)C1=CC=CC=C1C
InChIKey
InChIKey=IBSZBADLRHMFOT-UXHICEINSA-O
Formula
C26H33FN5OS
Mass
482.64
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
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
-
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
Toluenes Alkylarylthioethers Aralkylamines Fluorobenzenes Piperidines Aryl fluorides Quaternary ammonium salts Heteroaromatic compounds Trialkylamines Secondary carboxylic acid amides Amino acids and derivatives Sulfenyl compounds Azacyclic compounds Organofluorides Organic oxides Carbonyl compounds Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenyl-1,2,4-triazole - Aryl thioether - Fluorobenzene - Halobenzene - Toluene - Alkylarylthioether - Aralkylamine - Aryl halide - Aryl fluoride - Benzenoid - Monocyclic benzene moiety - Piperidine - Heteroaromatic compound - Quaternary ammonium salt - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Carboxamide group - Amino acid or derivatives - Azacycle - Sulfenyl compound - Thioether - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Organofluoride - Organohalogen compound - Organonitrogen compound - Amine - Organooxygen compound - Organosulfur compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic cation - 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