Compound Identification
SMILES
CC1=CC=CC=C1C1=NN2C(SC(C2=O)=C2C(=O)N(CC(N)=O)C3=CC=CC=C23)=N1
InChIKey
InChIKey=HWBPXKZJCXPXTC-UHFFFAOYSA-N
Formula
C21H15N5O3S
Mass
417.44
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Azoles
-
Subclass
Triazoles
-
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
Alpha amino acids and derivatives Indoles and derivatives Triazolothiazoles Toluenes Thiazoles Tertiary carboxylic acid amides Heteroaromatic compounds Primary carboxylic acid amides Lactams Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenyl-1,2,4-triazole - Alpha-amino acid or derivatives - Indole or derivatives - Triazolothiazole - Toluene - Monocyclic benzene moiety - Benzenoid - Tertiary carboxylic acid amide - Thiazole - Heteroaromatic compound - Primary carboxylic acid amide - Lactam - Carboxamide group - Carboxylic acid derivative - Azacycle - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Carbonyl group - Hydrocarbon derivative - Organic oxygen compound - 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