Compound Identification
SMILES
CC1=CC=C(C=C1)C1=NN=C2SC(=NN12)[C@@H](O)[C@H](O)[C@H](O)[C@@H](O)C1=NN2C(S1)=NN=C2C1=CC=C(C)C=C1
InChIKey
InChIKey=YIYJWSAMIKESBT-FZDBZEDMSA-N
Formula
C24H22N8O4S2
Mass
550.61
Taxonomic Classification
Taxonomy Tree
-
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
-
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
Toluenes Sugar alcohols Thiadiazoles Heteroaromatic compounds Secondary alcohols 1,2-diols Azacyclic compounds Organonitrogen compounds Hydrocarbon derivatives Aromatic alcohols
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenyl-1,2,4-triazole - Toluene - Monocyclic benzene moiety - Sugar alcohol - Benzenoid - Thiadiazole - Heteroaromatic compound - 1,2-diol - Secondary alcohol - Polyol - Azacycle - Aromatic alcohol - Hydrocarbon derivative - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Alcohol - 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