Compound Identification
SMILES
COC1=CC=C(C=C1)N1C=C(CN2C(=O)C3(C4=CC=CC=C24)C(C#N)=C(N)OC2=C3C(=O)N(C)C(=O)N2C)N=N1
InChIKey
InChIKey=KEAPQEPYIJZKGS-UHFFFAOYSA-N
Formula
C27H22N8O5
Mass
538.524
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-1,2,3-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-1,2,3-triazoles
Alternative Parents
Pyranopyridines Pyranopyrimidines Indoles and derivatives Methoxyanilines Methoxybenzenes Anisoles Phenoxy compounds Alkyl aryl ethers Pyrimidones Pyridines and derivatives Heteroaromatic compounds Vinylogous esters Vinylogous amides Tertiary carboxylic acid amides Ureas Lactams Ketene acetals Oxacyclic compounds Azacyclic compounds Nitriles Amines Carbonyl compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenyl-1,2,3-triazole - Pyranopyridine - Pyranopyrimidine - Indole or derivatives - Methoxyaniline - Anisole - Phenol ether - Phenoxy compound - Methoxybenzene - Pyrimidone - Alkyl aryl ether - Monocyclic benzene moiety - Pyridine - Pyrimidine - Benzenoid - Tertiary carboxylic acid amide - Heteroaromatic compound - Vinylogous amide - Vinylogous ester - Urea - Carboxamide group - Ketene acetal or derivatives - Lactam - Oxacycle - Azacycle - Carboxylic acid derivative - Ether - Carbonitrile - Nitrile - Amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Cyanide - Carbonyl group - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenyl-1,2,3-triazoles. These are organic compounds containing a 1,2,3-triazole substituted by a phenyl group.
External Descriptors
Not available