Compound Identification
SMILES
O=C1C(SC2=CC=CC=C12)=C1C(=O)NC(=O)NC1=O
InChIKey
InChIKey=BUUXKSVKSLMNAZ-UHFFFAOYSA-N
Formula
C12H6N2O4S
Mass
274.25
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Diazines
-
Subclass
Pyrimidines and pyrimidine derivatives
-
Level 5
Pyrimidones
- Level 6 Barbituric acid derivatives
-
Level 5
Pyrimidones
-
Subclass
Pyrimidines and pyrimidine derivatives
-
Class
Diazines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazines
Subclass
Pyrimidines and pyrimidine derivatives
Intermediate Tree Nodes
Pyrimidones
Direct Parent
Barbituric acid derivatives
Alternative Parents
Aryl thioethers Aryl ketones N-acyl ureas Vinylogous thioesters Diazinanes Benzenoids Dicarboximides Thioenol ethers Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Barbiturate - Aryl thioether - Aryl ketone - N-acyl urea - Ureide - 1,3-diazinane - Benzenoid - Vinylogous thioester - Dicarboximide - Ketone - Carbonic acid derivative - Thioenolether - Urea - Carboxylic acid derivative - Azacycle - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organic oxide - Organopnictogen compound - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as barbituric acid derivatives. These are compounds containing a perhydropyrimidine ring substituted at C-2, -4 and -6 by oxo groups.
External Descriptors
Not available