Compound Identification
SMILES
CCC1(CCSC(N)=N)C(=O)NC(=O)NC1=O
InChIKey
InChIKey=YFJVJSRNDAPRCF-UHFFFAOYSA-N
Formula
C9H14N4O3S
Mass
258.3
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
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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
N-acyl ureas Diazinanes Dicarboximides Isothioureas Sulfenyl compounds Carboximidamides Azacyclic compounds Organopnictogen compounds Organic oxides Imines Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
Barbiturate - N-acyl urea - Ureide - 1,3-diazinane - Dicarboximide - Isothiourea - Carbonic acid derivative - Urea - Carboxylic acid derivative - Azacycle - Sulfenyl compound - Carboximidamide - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Imine - Organopnictogen compound - Organic oxygen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Aliphatic heteromonocyclic 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