Compound Identification
SMILES
CN(C)C1N(N=C2N1S(=O)(=O)C1=CC=CC=C21)C(=O)C1=CC=CC=C1Br
InChIKey
InChIKey=HPZAHWIPSJMPOH-UHFFFAOYSA-N
Formula
C17H15BrN4O3S
Mass
435.3
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
Benzothiazoles Benzoyl derivatives Bromobenzenes Aryl bromides Imidolactams Vinylogous halides Triazolines Organosulfonic acids and derivatives Ortho amides Orthocarboxylic acid derivatives Amidrazones Azacyclic compounds Amidines Amines Hydrocarbon derivatives Organic oxides Organobromides Organooxygen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-halobenzoic acid or derivatives - 1,2-benzothiazole - Benzoyl - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Imidolactam - Triazoline - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Vinylogous halide - Orthocarboxylic acid derivative - Ortho amide - Carboxylic acid amidrazone - Organoheterocyclic compound - Amidine - Carboxylic acid derivative - Azacycle - Organooxygen compound - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organobromide - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Amine - 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