Compound Identification
SMILES
CCCCSC1(SCCCC)N=C(N)C2(C#N)C(C3=CC=C(Br)C=C3)C12C#N
InChIKey
InChIKey=WBCYURXPKSQZPY-UHFFFAOYSA-N
Formula
C21H25BrN4S2
Mass
477.48
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Halobenzenes
- Level 5 Bromobenzenes
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Subclass
Halobenzenes
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Halobenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Bromobenzenes
Alternative Parents
Tetrahydropyridines Imidolactams Aryl bromides Pyrrolines Sulfenyl compounds Propargyl-type 1,3-dipolar organic compounds Nitriles Dialkylthioethers Carboximidamides Carboxamidines Azacyclic compounds Organobromides Hydrocarbon derivatives Amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Bromobenzene - Tetrahydropyridine - Aryl bromide - Aryl halide - Imidolactam - Pyrroline - Amidine - Carboxylic acid amidine - Carbonitrile - Nitrile - Azacycle - Organoheterocyclic compound - Thioether - Carboximidamide - Sulfenyl compound - Dialkylthioether - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organosulfur compound - Cyanide - Hydrocarbon derivative - Amine - Organic nitrogen compound - Organohalogen compound - Organobromide - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as bromobenzenes. These are organic compounds containing a bromine atom attached to a benzene ring.
External Descriptors
Not available