Compound Identification
SMILES
CCOC(=O)C1=C(SC)N=C(N)N2C(=NN=C12)C1=CC=C(C=C1)[N+]([O-])=O
InChIKey
InChIKey=BTBOVTUAGKHNSP-UHFFFAOYSA-N
Formula
C15H14N6O4S
Mass
374.38
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
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
Triazolopyrimidines Pyrimidinecarboxylic acids Nitrobenzenes Nitroaromatic compounds Alkylarylthioethers Aminopyrimidines and derivatives Vinylogous thioesters Vinylogous amides Heteroaromatic compounds Amino acids and derivatives Carboxylic acid esters Sulfenyl compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Organic zwitterions Organooxygen compounds Hydrocarbon derivatives Organic salts Primary amines Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenyl-1,2,4-triazole - Triazolopyrimidine - Pyrimidine-5-carboxylic acid or derivatives - Pyrimidine-5-carboxylic acid - Nitrobenzene - Aryl thioether - Nitroaromatic compound - Aminopyrimidine - Alkylarylthioether - Monocyclic benzene moiety - Benzenoid - Pyrimidine - Vinylogous thioester - Heteroaromatic compound - Vinylogous amide - Carboxylic acid ester - C-nitro compound - Organic nitro compound - Amino acid or derivatives - Carboxylic acid derivative - Azacycle - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Thioether - Sulfenyl compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic salt - Organosulfur compound - Primary amine - Organic oxide - Amine - Hydrocarbon derivative - Organic zwitterion - Organic nitrogen 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