Compound Identification
SMILES
CN(CC1=CC=CC=C1Br)C(=O)CSC1=NN=NN1C1=CC=CC(C)=C1C
InChIKey
InChIKey=VMLFITUMWVAFIE-UHFFFAOYSA-N
Formula
C19H20BrN5OS
Mass
446.37
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
o-Xylenes Bromobenzenes Alkylarylthioethers Aryl bromides Tertiary carboxylic acid amides Heteroaromatic compounds Tertiary amines Amino acids and derivatives Sulfenyl compounds Azacyclic compounds Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenyltetrazole - Aryl thioether - O-xylene - Xylene - Bromobenzene - Halobenzene - Alkylarylthioether - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Tertiary carboxylic acid amide - Amino acid or derivatives - Tertiary amine - Carboxamide group - Azacycle - Sulfenyl compound - Thioether - Carboxylic acid derivative - Organosulfur compound - Organohalogen compound - Amine - Organobromide - Organonitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen 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