Compound Identification
SMILES
COC1=CC(CNC(C)=CC2=NSC(NC3=CC(Cl)=C(Cl)C=C3)=N2)=CC(OC)=C1OC
InChIKey
InChIKey=ONKUZUGBFOIFEV-UHFFFAOYSA-N
Formula
C21H22Cl2N4O3S
Mass
481.39
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
-
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
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Halobenzenes
Intermediate Tree Nodes
Chlorobenzenes
Direct Parent
Dichlorobenzenes
Alternative Parents
Phenylmethylamines Phenoxy compounds Methoxybenzenes Aniline and substituted anilines Anisoles Benzylamines Alkyl aryl ethers Aralkylamines Aryl chlorides Thiadiazoles Heteroaromatic compounds Enamines Dialkylamines Azacyclic compounds Hydrocarbon derivatives Organochlorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Anisole - Benzylamine - 1,2-dichlorobenzene - Phenol ether - Phenylmethylamine - Aniline or substituted anilines - Methoxybenzene - Phenoxy compound - Aralkylamine - Alkyl aryl ether - Aryl chloride - Aryl halide - Heteroaromatic compound - Thiadiazole - Azole - Organoheterocyclic compound - Azacycle - Secondary amine - Secondary aliphatic amine - Enamine - Ether - Hydrocarbon derivative - Organic oxygen compound - Organooxygen compound - Organic nitrogen compound - Amine - Organohalogen compound - Organochloride - Organonitrogen 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