Compound Identification
SMILES
CC(O)(C(=S)NC1=CC=CC=C1)C1=[NH+]CCCN1
InChIKey
InChIKey=UPIOKBUPRMTTNK-UHFFFAOYSA-O
Formula
C13H18N3OS
Mass
264.37
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Diazines
-
Subclass
Pyrimidines and pyrimidine derivatives
- Level 5 Hydropyrimidines
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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
Not available
Direct Parent
Hydropyrimidines
Alternative Parents
Benzene and substituted derivatives Thioamides Tertiary alcohols Thiocarboxylic acid amides Carboximidamides Carboxamidines Azacyclic compounds Thiocarbonyl compounds Hydrocarbon derivatives Amines Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Monocyclic benzene moiety - Hydropyrimidine - 1,4,5,6-tetrahydropyrimidine - Benzenoid - Tertiary alcohol - Thioamide - Amidine - Carboxylic acid amidine - Azacycle - Thiocarboxylic acid amide - Carboximidamide - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Alcohol - Amine - Thiocarbonyl group - Organic nitrogen compound - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as hydropyrimidines. These are compounds containing a hydrogenated pyrimidine ring (i.e. containing less than the maximum number of double bonds.).
External Descriptors
Not available