Compound Identification
SMILES
OC(=O)[C@H]1CC[C@@H](C[C@H]1CC1=C(NC2=NC=CS2)C=CC=N1)SC1=C(Cl)C(Cl)=CC=C1
InChIKey
InChIKey=IXEMOXNLLBMJTJ-KKUMJFAQSA-N
Formula
C22H21Cl2N3O2S2
Mass
494.45
Taxonomic Classification
Taxonomy Tree
-
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
Thiophenol ethers Aminopyridines and derivatives Alkylarylthioethers Aryl chlorides 2-amino-1,3-thiazoles Heteroaromatic compounds Sulfenyl compounds Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Amines
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Aryl thioether - 1,2-dichlorobenzene - Thiophenol ether - Aminopyridine - Alkylarylthioether - Aryl chloride - Aryl halide - 1,3-thiazol-2-amine - Pyridine - Azole - Heteroaromatic compound - Thiazole - Carboxylic acid derivative - Carboxylic acid - Azacycle - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Sulfenyl compound - Thioether - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Amine - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - 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