Compound Identification
SMILES
CCOC1=CC=C(C=C1)C1=NN=C2C=CC(S[C@@H](C(C)=O)C(=O)N(C)C)=NN12
InChIKey
InChIKey=ZJKCAEOIBHQZAJ-KRWDZBQOSA-N
Formula
C19H21N5O3S
Mass
399.47
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
-
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 Phenoxy compounds Phenol ethers Alkyl aryl ethers Alkylarylthioethers 1,3-dicarbonyl compounds Pyridazines and derivatives N-acyl amines Tertiary carboxylic acid amides Heteroaromatic compounds Ketones Sulfenyl compounds Azacyclic compounds Hydrocarbon derivatives Organonitrogen compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenyl-1,2,4-triazole - Triazolopyridazine - Phenoxy compound - Aryl thioether - Phenol ether - Alkyl aryl ether - Alkylarylthioether - Monocyclic benzene moiety - N-acyl-amine - Benzenoid - 1,3-dicarbonyl compound - Pyridazine - Heteroaromatic compound - Tertiary carboxylic acid amide - Carboxamide group - Ketone - Carboxylic acid derivative - Ether - Azacycle - Sulfenyl compound - Thioether - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Organic oxide - 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