Compound Identification
SMILES
BrC1=CC=C(S1)C=NNC(=O)C1=CC=CC=C1Br
InChIKey
InChIKey=MEABXBAFVXVJHG-UHFFFAOYSA-N
Formula
C12H8Br2N2OS
Mass
388.08
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
Benzoyl derivatives Bromobenzenes 2,5-disubstituted thiophenes Aryl bromides Vinylogous halides Heteroaromatic compounds Carboxylic acids and derivatives Organooxygen compounds Organonitrogen compounds Organobromides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-halobenzoic acid or derivatives - Benzoyl - Bromobenzene - Halobenzene - 2,5-disubstituted thiophene - Aryl bromide - Aryl halide - Heteroaromatic compound - Vinylogous halide - Thiophene - Carboxylic acid derivative - Organoheterocyclic compound - Organobromide - Organohalogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organooxygen 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