Compound Identification
SMILES
CC1=CC=C(C=C1)C1CC(=NN1C(=O)CSC1=NN=C(CNC(=O)C2=CC=CO2)N1C1=C(C)C=CC(C)=C1)C1=CC=CS1
InChIKey
InChIKey=PMNQUQRSPPIHMS-UHFFFAOYSA-N
Formula
C32H30N6O3S2
Mass
610.75
Taxonomic Classification
Taxonomy Tree
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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
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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
p-Xylenes 2-heteroaryl carboxamides Furoic acid and derivatives Toluenes Alkylarylthioethers Thiophenes Pyrazolines Heteroaromatic compounds Secondary carboxylic acid amides Oxacyclic compounds Azacyclic compounds Sulfenyl compounds Organic oxides Hydrocarbon derivatives Organopnictogen compounds Carbonyl compounds Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenyl-1,2,4-triazole - 2-heteroaryl carboxamide - Xylene - P-xylene - Aryl thioether - Furoic acid or derivatives - Alkylarylthioether - Toluene - Monocyclic benzene moiety - Benzenoid - Furan - Pyrazoline - Heteroaromatic compound - Thiophene - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid derivative - Oxacycle - Thioether - Azacycle - Sulfenyl compound - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Carbonyl group - Organic nitrogen compound - Organic oxide - Organic oxygen compound - Organopnictogen compound - 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