Compound Identification
SMILES
CSC1=C(C=NNC(=O)C2=C(Cl)C=C(Cl)C=C2)C(C=NNC(=O)C2=C(Cl)C=C(Cl)C=C2)=C(SC)S1
InChIKey
InChIKey=SRVTVXXJKOFQKW-UHFFFAOYSA-N
Formula
C22H16Cl4N4O2S3
Mass
606.38
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
4-halobenzoic acids and derivatives
Alternative Parents
2-halobenzoic acids and derivatives Dichlorobenzenes Benzoyl derivatives Alkylarylthioethers Aryl chlorides Vinylogous halides Thiophenes Heteroaromatic compounds Sulfenyl compounds Carboxylic acids and derivatives Organooxygen compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-halobenzoic acid or derivatives - 4-halobenzoic acid or derivatives - Aryl thioether - Benzoyl - 1,3-dichlorobenzene - Chlorobenzene - Halobenzene - Alkylarylthioether - Aryl chloride - Aryl halide - Heteroaromatic compound - Thiophene - Vinylogous halide - Thioether - Organoheterocyclic compound - Carboxylic acid derivative - Sulfenyl compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as 4-halobenzoic acids and derivatives. These are benzoic acids or derivatives carrying a halogen atom at the 4-position of the benzene ring.
External Descriptors
Not available