Compound Identification
SMILES
COC1=CC(OC)=CC(NC2=C(C(N)=O)C3=NC(=NN3C(N[C@@H]3CCCC[C@@H]3N)=N2)C2=CC=CC=C2)=C1
InChIKey
InChIKey=QMTFEPLRHYDWQT-VQTJNVASSA-N
Formula
C26H30N8O3
Mass
502.579
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
Dimethoxybenzenes Triazolopyrimidines Pyrimidinecarboxamides Methoxyanilines Phenoxy compounds Anisoles Alkyl aryl ethers Aminopyrimidines and derivatives Cyclohexylamines Imidolactams Heteroaromatic compounds Vinylogous amides Primary carboxylic acid amides Amino acids and derivatives Azacyclic compounds Monoalkylamines Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenyl-1,2,4-triazole - Dimethoxybenzene - M-dimethoxybenzene - Pyrimidinecarboxamide - Pyrimidine-5-carboxylic acid or derivatives - Triazolopyrimidine - Methoxyaniline - Methoxybenzene - Phenoxy compound - Aniline or substituted anilines - Anisole - Phenol ether - Aminopyrimidine - Cyclohexylamine - Alkyl aryl ether - Imidolactam - Benzenoid - Monocyclic benzene moiety - Pyrimidine - Heteroaromatic compound - Vinylogous amide - Amino acid or derivatives - Carboxamide group - Primary carboxylic acid amide - Ether - Carboxylic acid derivative - Azacycle - Organonitrogen compound - Primary aliphatic amine - Amine - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organooxygen compound - Organic oxygen compound - Primary amine - 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