Compound Identification
SMILES
ClC1=CC(=C(Cl)C=C1)C1=CC(NC2=NC=CC(=N2)C2=NC=CS2)=CC=C1
InChIKey
InChIKey=HWLDTWIUEHDDBC-UHFFFAOYSA-N
Formula
C19H12Cl2N4S
Mass
399.29
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Biphenyls and derivatives
-
Level 5
Chlorinated biphenyls
- Level 6 Polychlorinated biphenyls
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Level 5
Chlorinated biphenyls
-
Subclass
Biphenyls and derivatives
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Biphenyls and derivatives
Intermediate Tree Nodes
Chlorinated biphenyls
Direct Parent
Polychlorinated biphenyls
Alternative Parents
Dichlorobenzenes Aniline and substituted anilines Aminopyrimidines and derivatives Aryl chlorides Thiazoles Heteroaromatic compounds Secondary amines Azacyclic compounds Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Polychlorinated biphenyl - Aniline or substituted anilines - 1,4-dichlorobenzene - Aminopyrimidine - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Pyrimidine - Heteroaromatic compound - Azole - Thiazole - Azacycle - Organoheterocyclic compound - Secondary amine - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organonitrogen compound - Organochloride - Organohalogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as polychlorinated biphenyls. These are organic compounds containing at least two chlorine atoms attached to either benzene ring of the biphenyl moiety.
External Descriptors
Not available