Compound Identification
SMILES
CC1=C(Cl)C(=O)N2NC(NC(=O)C3=CC=CC=C3Cl)=NC2=N1
InChIKey
InChIKey=WRVRHHGPLYXLCM-UHFFFAOYSA-N
Formula
C13H9Cl2N5O2
Mass
338.15
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Benzoic acids and derivatives
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Halobenzoic acids and derivatives
Direct Parent
2-halobenzoic acids and derivatives
Alternative Parents
Triazolopyrimidines Benzamides Benzoyl derivatives Pyrimidones Chlorobenzenes Halopyrimidines Aryl chlorides Vinylogous halides Triazoles Heteroaromatic compounds Secondary carboxylic acid amides Lactams Azacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides Organonitrogen compounds Organooxygen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-halobenzoic acid or derivatives - Benzamide - Triazolopyrimidine - Benzoyl - Chlorobenzene - Halobenzene - Halopyrimidine - Pyrimidone - Aryl chloride - Aryl halide - Pyrimidine - 1,2,4-triazole - Triazole - Heteroaromatic compound - Vinylogous halide - Azole - Secondary carboxylic acid amide - Carboxamide group - Lactam - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Organooxygen compound - Organic oxide - Organopnictogen compound - Hydrocarbon derivative - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Organochloride - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 2-halobenzoic acids and derivatives. These are benzoic acids or derivatives carrying a halogen atom at the 2-position of the benzene ring.
External Descriptors
Not available