Compound Identification
SMILES
CCSC1=NC=C(Cl)C(=N1)C(=O)NNC(=O)C1=CC=CC=C1Br
InChIKey
InChIKey=SRZDHPBYDVHJRW-UHFFFAOYSA-N
Formula
C14H12BrClN4O2S
Mass
415.69
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Benzoic acids and derivatives
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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
Pyrimidinecarboxylic acids and derivatives Benzoyl derivatives Alkylarylthioethers Bromobenzenes Halopyrimidines Aryl bromides Aryl chlorides Vinylogous halides Heteroaromatic compounds Carboxylic acid hydrazides Sulfenyl compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Organobromides Organochlorides Organonitrogen compounds Organooxygen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-halobenzoic acid or derivatives - Pyrimidine-6-carboxylic acid or derivatives - Aryl thioether - Benzoyl - Bromobenzene - Halobenzene - Alkylarylthioether - Halopyrimidine - Aryl bromide - Aryl chloride - Aryl halide - Pyrimidine - Heteroaromatic compound - Vinylogous halide - Carboxylic acid hydrazide - Sulfenyl compound - Organoheterocyclic compound - Carboxylic acid derivative - Azacycle - Thioether - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organobromide - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Aromatic heteromonocyclic 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