Compound Identification
SMILES
CCCC[C@H](SC1=NN2C(C=C1)=NN=C2C1=CC=C(C)C=C1)C(O)=O
InChIKey
InChIKey=KVHVUAGJHXLQOM-AWEZNQCLSA-N
Formula
C18H20N4O2S
Mass
356.44
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
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
-
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
Triazolopyridazines Medium-chain fatty acids Toluenes Thia fatty acids Alkylarylthioethers Heterocyclic fatty acids Pyridazines and derivatives Heteroaromatic compounds Sulfenyl compounds Azacyclic compounds Carboxylic acids Monocarboxylic acids and derivatives Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenyl-1,2,4-triazole - Triazolopyridazine - Aryl thioether - Medium-chain fatty acid - Heterocyclic fatty acid - Thia fatty acid - Toluene - Alkylarylthioether - Monocyclic benzene moiety - Pyridazine - Benzenoid - Fatty acyl - Fatty acid - Heteroaromatic compound - Thioether - Monocarboxylic acid or derivatives - Sulfenyl compound - Azacycle - Carboxylic acid derivative - Carboxylic acid - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Carbonyl group - Aromatic heteropolycyclic 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