Compound Identification
SMILES
CCSC12N(C)C(=O)C(C(=O)N1C)(C1=CC=CC=C1)C(N(CC)CC)=C2C
InChIKey
InChIKey=JLVCZVIWOLIQIK-UHFFFAOYSA-N
Formula
C21H29N3O2S
Mass
387.54
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Diazines
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Subclass
Pyrimidines and pyrimidine derivatives
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Level 5
Pyrimidones
- Level 6 Thiobarbituric acid derivatives
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Level 5
Pyrimidones
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Subclass
Pyrimidines and pyrimidine derivatives
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Class
Diazines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazines
Subclass
Pyrimidines and pyrimidine derivatives
Intermediate Tree Nodes
Pyrimidones
Direct Parent
Thiobarbituric acid derivatives
Alternative Parents
Diazinanes Benzene and substituted derivatives Tertiary carboxylic acid amides Trialkylamines Lactams Amino acids and derivatives Sulfenyl compounds Enamines Dialkylthioethers Azacyclic compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Thiobarbiturate - Monocyclic benzene moiety - 1,3-diazinane - Benzenoid - Tertiary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Lactam - Tertiary amine - Tertiary aliphatic amine - Thioether - Azacycle - Dialkylthioether - Sulfenyl compound - Carboxylic acid derivative - Enamine - Organic oxide - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organosulfur compound - Amine - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organopnictogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as thiobarbituric acid derivatives. These are organic compounds containing a 2-thioxodihydropyrimidine-4,6(1H,5H)-dione skeleton.
External Descriptors
Not available