Compound Identification
SMILES
CC1=C(CCSC(=O)NC(CC(O)=O)C(=O)CN2N=NC(SC3=C(Cl)C=CC=C3Cl)=N2)SC=N1
InChIKey
InChIKey=DKMGYBIIBVVKRB-UHFFFAOYSA-N
Formula
C19H18Cl2N6O4S3
Mass
561.47
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organosulfur compounds
-
Class
Thioethers
-
Subclass
Aryl thioethers
- Level 5 Diarylthioethers
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Subclass
Aryl thioethers
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Class
Thioethers
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Superclass
Organosulfur compounds
Kingdom
Organic compounds
Superclass
Organosulfur compounds
Class
Thioethers
Subclass
Aryl thioethers
Intermediate Tree Nodes
Not available
Direct Parent
Diarylthioethers
Alternative Parents
Thiophenol ethers Dichlorobenzenes Gamma-keto acids and derivatives 4,5-disubstituted thiazoles Aryl chlorides Tetrazoles Heteroaromatic compounds Thiocarbamic acid derivatives Ketones Carboxylic acids Azacyclic compounds Sulfenyl compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Organic oxides Organochlorides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Diarylthioether - 1,3-dichlorobenzene - Thiophenol ether - Gamma-keto acid - 4,5-disubstituted 1,3-thiazole - Halobenzene - Chlorobenzene - Aryl chloride - Aryl halide - Keto acid - Monocyclic benzene moiety - Benzenoid - Azole - Heteroaromatic compound - Thiazole - Tetrazole - Ketone - Thiocarbamic acid derivative - Azacycle - Carboxylic acid derivative - Carboxylic acid - Organoheterocyclic compound - Sulfenyl compound - Monocarboxylic acid or derivatives - Organic oxide - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organic nitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as diarylthioethers. These are organosulfur compounds containing a thioether group that is substituted by two aryl groups.
External Descriptors
Not available