Compound Identification
SMILES
CCOC(=O)C1=C(CSC2=C(C#N)C(C3=CC=CS3)=C(C#N)C(N)=N2)OC(N)=C(C#N)C1C1=CC=CC=C1
InChIKey
InChIKey=IRDJIAHINOZBGZ-UHFFFAOYSA-N
Formula
C27H20N6O3S2
Mass
540.62
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organosulfur compounds
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Class
Thioethers
- 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
Aryl thioethers
Alternative Parents
3-pyridinecarbonitriles Alkylarylthioethers Aminopyridines and derivatives Pyrans Primary aromatic amines Benzene and substituted derivatives Imidolactams Vinylogous esters Thiophenes Enoate esters Heteroaromatic compounds Amino acids and derivatives Ketene acetals Monocarboxylic acids and derivatives Nitriles Azacyclic compounds Sulfenyl compounds Oxacyclic compounds Carbonyl compounds Organic oxides Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Aryl thioether - 3-pyridinecarbonitrile - Alkylarylthioether - Aminopyridine - Benzenoid - Imidolactam - Monocyclic benzene moiety - Pyridine - Pyran - Primary aromatic amine - Enoate ester - Thiophene - Alpha,beta-unsaturated carboxylic ester - Heteroaromatic compound - Vinylogous ester - Amino acid or derivatives - Ketene acetal or derivatives - Carboxylic acid ester - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Oxacycle - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Primary amine - Hydrocarbon derivative - Organopnictogen compound - Carbonyl group - Amine - Cyanide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as aryl thioethers. These are organosulfur compounds containing a thioether group that is substituted by an aryl group.
External Descriptors
Not available