Compound Identification
SMILES
COC1=CC=C(C=C1)N1N=NC2=CN=C(N[C@H]3CCCN(C3)C(=O)OC(C)(C)C)N=C12
InChIKey
InChIKey=XAONWBNOVRQVOH-AWEZNQCLSA-N
Formula
C21H27N7O3
Mass
425.493
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Azoles
-
Subclass
Triazoles
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Level 5
Phenyltriazoles
- Level 6 Phenyl-1,2,3-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-1,2,3-triazoles
Alternative Parents
Triazolopyrimidines Piperidinecarboxylic acids Methoxyanilines Phenoxy compounds Methoxybenzenes Anisoles Alkyl aryl ethers Aminopiperidines Aminopyrimidines and derivatives Heteroaromatic compounds Carbamate esters Azacyclic compounds Carbonyl compounds Organic oxides Hydrocarbon derivatives Amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenyl-1,2,3-triazole - Piperidinecarboxylic acid - Triazolopyrimidine - Methoxyaniline - Anisole - Methoxybenzene - Phenol ether - Phenoxy compound - Alkyl aryl ether - Aminopyrimidine - 3-aminopiperidine - Monocyclic benzene moiety - Piperidine - Benzenoid - Pyrimidine - Heteroaromatic compound - Carbamic acid ester - Azacycle - Ether - Amine - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - 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