Compound Identification
SMILES
OC(=O)C1CC2CC(CCC2CN1)OC1=C(C=CC(=C1)N1C=CC2=CC=CC=C12)C1=NNN=N1
InChIKey
InChIKey=XAFJCOIZKWVHFD-UHFFFAOYSA-N
Formula
C25H26N6O3
Mass
458.522
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Azoles
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Subclass
Tetrazoles
- Level 5 Phenyltetrazoles and derivatives
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Subclass
Tetrazoles
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Class
Azoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azoles
Subclass
Tetrazoles
Intermediate Tree Nodes
Not available
Direct Parent
Phenyltetrazoles and derivatives
Alternative Parents
Phenylpyrroles Alpha amino acids Piperidinecarboxylic acids Indoles Phenoxy compounds Phenol ethers Alkyl aryl ethers Heteroaromatic compounds Amino acids Monocarboxylic acids and derivatives Dialkylamines Carboxylic acids Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-phenylpyrrole - Phenyltetrazole - Alpha-amino acid - Alpha-amino acid or derivatives - Indole - Indole or derivatives - Piperidinecarboxylic acid - Phenoxy compound - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Substituted pyrrole - Piperidine - Heteroaromatic compound - Pyrrole - Amino acid or derivatives - Amino acid - Secondary amine - Azacycle - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Ether - Secondary aliphatic amine - Carboxylic acid - Organic oxygen compound - Hydrocarbon derivative - Carbonyl group - Organic nitrogen compound - Organonitrogen compound - Organic oxide - Amine - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenyltetrazoles and derivatives. These are compounds containing a phenyltetrazole skeleton, which consists of a tetrazole bound to a phenyl group.
External Descriptors
Not available