Compound Identification
SMILES
BrC1=CC=C(C=C1)C1=CC(=NO1)C(=O)NC1=NN=C(S1)N1CCCCCC1
InChIKey
InChIKey=ZJJNUJOOFJRUAR-UHFFFAOYSA-N
Formula
C18H18BrN5O2S
Mass
448.34
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
-
Subclass
Carboxylic acid derivatives
-
Level 5
Carboxylic acid amides
- Level 6 2-heteroaryl carboxamides
-
Level 5
Carboxylic acid amides
-
Subclass
Carboxylic acid derivatives
-
Class
Carboxylic acids and derivatives
-
Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Carboxylic acids and derivatives
Subclass
Carboxylic acid derivatives
Intermediate Tree Nodes
Carboxylic acid amides
Direct Parent
2-heteroaryl carboxamides
Alternative Parents
Dialkylarylamines Bromobenzenes Azepanes 2-amino-5-substituted-1,3,4-thiadiazoles Aryl bromides Isoxazoles Heteroaromatic compounds Secondary carboxylic acid amides Oxacyclic compounds Azacyclic compounds Organooxygen compounds Organobromides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-heteroaryl carboxamide - Dialkylarylamine - Azepane - 2-amino-5-substituted-1,3,4-thiadiazole - Bromobenzene - Halobenzene - 2-amino-1,3,4-thiadiazole - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Azole - Thiadiazole - Isoxazole - Secondary carboxylic acid amide - Oxacycle - Azacycle - Organoheterocyclic compound - Organooxygen compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organohalogen compound - Organobromide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as 2-heteroaryl carboxamides. These are compounds containing a heteroaromatic ring that carries a carboxamide group.
External Descriptors
Not available