Compound Identification
SMILES
CCOC1=CC(=CC2=C(N)N3C(SCC)=NSC3=NC2=O)C=CC1=O
InChIKey
InChIKey=LTVWXJQEXSATPF-UHFFFAOYSA-N
Formula
C16H16N4O3S2
Mass
376.45
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbonyl compounds
-
Level 5
Ketones
-
Level 6
Cyclic ketones
-
Level 7
Quinomethanes
- Level 8 P-quinomethanes
-
Level 7
Quinomethanes
-
Level 6
Cyclic ketones
-
Level 5
Ketones
-
Subclass
Carbonyl compounds
-
Class
Organooxygen compounds
-
Superclass
Organic oxygen compounds
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organooxygen compounds
Subclass
Carbonyl compounds
Intermediate Tree Nodes
Ketones - Cyclic ketones - Quinomethanes
Direct Parent
P-quinomethanes
Alternative Parents
Pyrimidones Aminopyrimidines and derivatives Alkylarylthioethers Vinylogous amides Thiadiazoles Heteroaromatic compounds Sulfenyl compounds Azacyclic compounds Primary amines Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Aryl thioether - P-quinomethane - Aminopyrimidine - Pyrimidone - Alkylarylthioether - Pyrimidine - Azole - Heteroaromatic compound - Vinylogous amide - Thiadiazole - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Thioether - Primary amine - Hydrocarbon derivative - Organosulfur compound - Organonitrogen compound - Amine - Organic nitrogen compound - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as p-quinomethanes. These are organic compounds containing a benzene ring conjugated to a methylidene group and a ketone at carbon atoms 1 and 4, respectively.
External Descriptors
Not available