Compound Identification
SMILES
BrC1=CC=C(C=C1)N1N=NN=C1SCC(=O)C1=CC2=CC=CC=C2OC1=O
InChIKey
InChIKey=OXSJKYDSHVRYDW-UHFFFAOYSA-N
Formula
C18H11BrN4O3S
Mass
443.28
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
Coumarins and derivatives 1-benzopyrans Aryl alkyl ketones Pyranones and derivatives Alkylarylthioethers Bromobenzenes Aryl bromides Heteroaromatic compounds Lactones Sulfenyl compounds Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Organobromides Organonitrogen compounds Aldehydes Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Coumarin - Phenyltetrazole - Benzopyran - 1-benzopyran - Aryl thioether - Aryl ketone - Aryl alkyl ketone - Bromobenzene - Halobenzene - Pyranone - Alkylarylthioether - Benzenoid - Pyran - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Heteroaromatic compound - Ketone - Lactone - Oxacycle - Azacycle - Sulfenyl compound - Thioether - Hydrocarbon derivative - Organohalogen compound - Organobromide - Organonitrogen compound - Organic oxygen compound - Aldehyde - Organic nitrogen compound - Organooxygen compound - Organosulfur compound - Organopnictogen compound - Organic oxide - 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