Compound Identification
SMILES
CN(C)\C=C(/C(=O)C(Cl)(Cl)Cl)C1=NN=NN1C1=CC=C(Br)C=C1
InChIKey
InChIKey=UBJCLGSOVXEJSV-JXMROGBWSA-N
Formula
C13H11BrCl3N5O
Mass
439.52
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
Bromobenzenes Alpha-branched alpha,beta-unsaturated ketones Aryl bromides Acryloyl compounds Vinylogous amides Alpha-chloroketones Enones Heteroaromatic compounds Trialkylamines Enamines Azacyclic compounds Organochlorides Alkyl chlorides Hydrocarbon derivatives Organic oxides Organobromides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenyltetrazole - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Alpha-branched alpha,beta-unsaturated-ketone - Acryloyl-group - Alpha-haloketone - Alpha-chloroketone - Enone - Heteroaromatic compound - Alpha,beta-unsaturated ketone - Vinylogous amide - Tertiary aliphatic amine - Tertiary amine - Ketone - Enamine - Azacycle - Organobromide - Organohalogen compound - Alkyl chloride - Organic oxide - Amine - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Alkyl halide - Organochloride - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic 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