Compound Identification
SMILES
CC1=NN(C2=NC(=S)C=C(N)C12Br)C1=CC=CC=C1
InChIKey
InChIKey=ZJEAHRDKDISYML-UHFFFAOYSA-N
Formula
C13H11BrN4S
Mass
335.22
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzene and substituted derivatives
Alternative Parents
Pyrazolines Propargyl-type 1,3-dipolar organic compounds Enamines Azacyclic compounds Thiocarbonyl compounds Organobromides Monoalkylamines Hydrocarbon derivatives Alkyl bromides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Monocyclic benzene moiety - Pyrazoline - Enamine - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Azacycle - Hydrocarbon derivative - Primary amine - Organosulfur compound - Organonitrogen compound - Organobromide - Organohalogen compound - Primary aliphatic amine - Alkyl bromide - Thiocarbonyl group - Alkyl halide - Amine - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzene and substituted derivatives. These are aromatic compounds containing one monocyclic ring system consisting of benzene.
External Descriptors
Not available