Compound Identification
SMILES
ClC1=CC(Cl)=C(COC2=CC=CC(C=C3C(=O)N=C4SC(=NN4C3=N)C3=CC=CC=C3Cl)=C2)C=C1
InChIKey
InChIKey=DFQVVYMOZABPLF-UHFFFAOYSA-N
Formula
C25H15Cl3N4O2S
Mass
541.83
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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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
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Class
Benzene and substituted derivatives
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Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Halobenzenes
Intermediate Tree Nodes
Chlorobenzenes
Direct Parent
Dichlorobenzenes
Alternative Parents
Phenol ethers Phenoxy compounds Alkyl aryl ethers Pyrimidones Aryl chlorides Hydropyrimidines Imidolactams Thiadiazolines N-acylimines Amidines Carboxylic acids and derivatives Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,3-dichlorobenzene - Phenol ether - Phenoxy compound - Alkyl aryl ether - Pyrimidone - Aryl chloride - Aryl halide - Hydropyrimidine - Imidolactam - 1,4,5,6-tetrahydropyrimidine - Pyrimidine - Thiadiazoline - N-acylimine - Carboxylic acid derivative - Azacycle - Ether - Organoheterocyclic compound - Organic 1,3-dipolar compound - Amidine - Propargyl-type 1,3-dipolar organic compound - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic nitrogen compound - Aromatic heteropolycyclic 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