Compound Identification
SMILES
COC1=C(C)C=C2C(SC(C(=O)NC3=NNN=N3)=C2SC2=CC(Cl)=CC=C2)=C1
InChIKey
InChIKey=NLQQHLRBMOKRNQ-UHFFFAOYSA-N
Formula
C18H14ClN5O2S2
Mass
431.91
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organosulfur compounds
-
Class
Thioethers
-
Subclass
Aryl thioethers
- Level 5 Diarylthioethers
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Subclass
Aryl thioethers
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Class
Thioethers
-
Superclass
Organosulfur compounds
Kingdom
Organic compounds
Superclass
Organosulfur compounds
Class
Thioethers
Subclass
Aryl thioethers
Intermediate Tree Nodes
Not available
Direct Parent
Diarylthioethers
Alternative Parents
1-benzothiophenes Thiophenol ethers Thiophene carboxamides 2-heteroaryl carboxamides Anisoles Alkyl aryl ethers Chlorobenzenes Vinylogous thioesters Aryl chlorides Tetrazoles Heteroaromatic compounds Secondary carboxylic acid amides Sulfenyl compounds Azacyclic compounds Organic oxides Organochlorides Hydrocarbon derivatives Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Diarylthioether - Benzothiophene - 1-benzothiophene - Thiophene carboxylic acid or derivatives - 2-heteroaryl carboxamide - Thiophene carboxamide - Thiophenol ether - Phenol ether - Anisole - Halobenzene - Chlorobenzene - Alkyl aryl ether - Aryl chloride - Aryl halide - Vinylogous thioester - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Azole - Tetrazole - Thiophene - Secondary carboxylic acid amide - Carboxamide group - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Carboxylic acid derivative - Ether - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Organonitrogen compound - Hydrocarbon derivative - Organochloride - Organohalogen compound - Aromatic heteropolycyclic 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