Compound Identification
SMILES
C[C@@H](O)CNC1=CC(SC2=NC3=CC=CC=C3N2)=C(C=C1)[N+]([O-])=O
InChIKey
InChIKey=XSLJHXLUHMFHLY-SNVBAGLBSA-N
Formula
C16H16N4O3S
Mass
344.39
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organosulfur compounds
-
Class
Thioethers
-
Subclass
Aryl thioethers
- Level 5 Diarylthioethers
-
Subclass
Aryl thioethers
-
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
Benzimidazoles Nitrobenzenes Thiophenol ethers Aniline and substituted anilines Nitroaromatic compounds Phenylalkylamines Secondary alkylarylamines Heteroaromatic compounds Imidazoles 1,2-aminoalcohols Secondary alcohols Propargyl-type 1,3-dipolar organic compounds Sulfenyl compounds Azacyclic compounds Organic oxoazanium compounds Organic oxides Organic zwitterions Hydrocarbon derivatives Organic salts
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Diarylthioether - Benzimidazole - Nitrobenzene - Nitroaromatic compound - Thiophenol ether - Aniline or substituted anilines - Phenylalkylamine - Secondary aliphatic/aromatic amine - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Azole - Imidazole - Organic nitro compound - C-nitro compound - Secondary alcohol - 1,2-aminoalcohol - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Azacycle - Sulfenyl compound - Secondary amine - Organic oxoazanium - Amine - Organonitrogen compound - Organooxygen compound - Organic oxide - Organic nitrogen compound - Alcohol - Hydrocarbon derivative - Organic zwitterion - Organic oxygen compound - Organic salt - 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