Compound Identification
SMILES
ClC1=CC=CC(C2=NN=NN2CC2=CN=CC=C2)=C1Cl.OC1N=C(C2=CC=CC=C2Cl)C2=C(NC1=O)C=CC(Cl)=C2
InChIKey
InChIKey=KBDUEBDQIREKIN-UHFFFAOYSA-N
Formula
C28H19Cl4N7O2
Mass
627.31
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Azoles
-
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
1,4-benzodiazepines Alpha amino acids and derivatives Dichlorobenzenes Pyridines and derivatives Aryl chlorides Heteroaromatic compounds Secondary carboxylic acid amides Lactams Ketimines Propargyl-type 1,3-dipolar organic compounds Alkanolamines Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Not available
Substituents
Phenyltetrazole - 1,4-benzodiazepine - Benzodiazepine - Alpha-amino acid or derivatives - 1,2-dichlorobenzene - Halobenzene - Chlorobenzene - Benzenoid - Pyridine - Aryl halide - Aryl chloride - Monocyclic benzene moiety - Heteroaromatic compound - Carboxamide group - Ketimine - Secondary carboxylic acid amide - Lactam - Alkanolamine - Azacycle - Organic 1,3-dipolar compound - Carboxylic acid derivative - Propargyl-type 1,3-dipolar organic compound - Organic oxide - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Imine - Organochloride - Organohalogen 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