Compound Identification
SMILES
CC1=CC=CC=C1N1C(CC2=CC=CC=C2)=NN=C1SCC1=NC(=CS1)C(=O)N1CCC(CC1)N1C(=O)NC2=CC=CC=C12
InChIKey
InChIKey=XHVRLVRRFXIFLR-UHFFFAOYSA-N
Formula
C33H31N7O2S2
Mass
621.78
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Azoles
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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
Benzimidazoles N-acylpiperidines Thiazolecarboxamides 2-heteroaryl carboxamides 2,4-disubstituted thiazoles Toluenes Alkylarylthioethers N-substituted imidazoles Heteroaromatic compounds Tertiary carboxylic acid amides Ureas Azacyclic compounds Sulfenyl compounds Organonitrogen compounds Hydrocarbon derivatives Organooxygen compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenyl-1,2,4-triazole - Benzimidazole - N-acyl-piperidine - 2-heteroaryl carboxamide - Aryl thioether - Thiazolecarboxamide - Thiazolecarboxylic acid or derivatives - 2,4-disubstituted 1,3-thiazole - Alkylarylthioether - Toluene - Monocyclic benzene moiety - N-substituted imidazole - Piperidine - Benzenoid - Imidazole - Heteroaromatic compound - Tertiary carboxylic acid amide - Thiazole - Carboxamide group - Urea - Azacycle - Carboxylic acid derivative - Sulfenyl compound - Thioether - Organic oxygen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - 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