Compound Identification
SMILES
CCC1=CC2=C(S1)N=CN(NC(=O)C1=CC(Cl)=CC(Cl)=C1)C2=O
InChIKey
InChIKey=PYVHHTFYFHMTOV-UHFFFAOYSA-N
Formula
C15H11Cl2N3O2S
Mass
368.23
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
3-halobenzoic acids and derivatives
Alternative Parents
Thienopyrimidines Dichlorobenzenes Benzoyl derivatives 2,3,5-trisubstituted thiophenes Pyrimidones Aryl chlorides Heteroaromatic compounds Lactams Carboxylic acids and derivatives Azacyclic compounds Organooxygen compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-halobenzoic acid or derivatives - Thienopyrimidine - Benzoyl - 1,3-dichlorobenzene - 2,3,5-trisubstituted thiophene - Chlorobenzene - Halobenzene - Pyrimidone - Aryl chloride - Aryl halide - Pyrimidine - Heteroaromatic compound - Thiophene - Lactam - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 3-halobenzoic acids and derivatives. These are benzoic acids or derivatives carrying a halogen atom at the 3-position of the benzene ring.
External Descriptors
Not available