Compound Identification
SMILES
ClC1=CC=C(C=C1)C1=CSC(=N1)C(=C/NC1=CC(Cl)=C(Cl)C=C1)\C#N
InChIKey
InChIKey=HTJKASPYKRNBHH-XFXZXTDPSA-N
Formula
C18H10Cl3N3S
Mass
406.71
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Halobenzenes
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Level 5
Chlorobenzenes
- Level 6 Dichlorobenzenes
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Level 5
Chlorobenzenes
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Subclass
Halobenzenes
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Halobenzenes
Intermediate Tree Nodes
Chlorobenzenes
Direct Parent
Dichlorobenzenes
Alternative Parents
Aniline and substituted anilines 2,4-disubstituted thiazoles Aryl chlorides Heteroaromatic compounds Secondary amines Nitriles Enamines Azacyclic compounds Organopnictogen compounds Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
1,2-dichlorobenzene - Aniline or substituted anilines - 2,4-disubstituted 1,3-thiazole - Aryl chloride - Aryl halide - Azole - Thiazole - Heteroaromatic compound - Secondary amine - Nitrile - Carbonitrile - Enamine - Organoheterocyclic compound - Azacycle - Amine - Organonitrogen compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Organic nitrogen compound - Cyanide - Organopnictogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as dichlorobenzenes. These are compounds containing a benzene with exactly two chlorine atoms attached to it.
External Descriptors
Not available