Compound Identification
SMILES
CC1=C(C(Cl)=O)C(SC2=CC=CC=C2[N+]([O-])=O)=NC(=N1)C1=CC=CC=C1
InChIKey
InChIKey=MXSVGGYYKIYHTH-UHFFFAOYSA-N
Formula
C18H12ClN3O3S
Mass
385.82
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
Pyrimidinecarboxylic acids and derivatives Nitrobenzenes Thiophenol ethers Nitroaromatic compounds Vinylogous thioesters Heteroaromatic compounds Acyl chlorides Azacyclic compounds Sulfenyl compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives Organic salts Organochlorides Organonitrogen compounds Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Diarylthioether - Nitrobenzene - Pyrimidine-5-carboxylic acid or derivatives - Nitroaromatic compound - Thiophenol ether - Monocyclic benzene moiety - Pyrimidine - Benzenoid - Vinylogous thioester - Heteroaromatic compound - C-nitro compound - Organic nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Acyl halide - Organoheterocyclic compound - Sulfenyl compound - Azacycle - Acyl chloride - Organic oxoazanium - Organic salt - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organic oxide - Organohalogen compound - Organic oxygen compound - Hydrocarbon derivative - Organic cation - 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