Compound Identification
SMILES
CC(=O)C(C(C)=O)=C(NC1=CC=CC=C1)SC1C(=O)NN=C1N
InChIKey
InChIKey=ZZCGAOHBWPFPOO-UHFFFAOYSA-N
Formula
C15H16N4O3S
Mass
332.38
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Azolines
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Subclass
Pyrazolines
- Level 5 Pyrazolones
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Subclass
Pyrazolines
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Class
Azolines
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azolines
Subclass
Pyrazolines
Intermediate Tree Nodes
Not available
Direct Parent
Pyrazolones
Alternative Parents
Vinylogous thioesters Imidolactams Alpha-branched alpha,beta-unsaturated ketones Benzene and substituted derivatives Vinylogous amides Acryloyl compounds Enones Ketones Ketene acetals Amidrazones Sulfenyl compounds Azacyclic compounds Amidines Amines Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Pyrazolinone - Benzenoid - Alpha-branched alpha,beta-unsaturated-ketone - Imidolactam - Vinylogous thioester - Monocyclic benzene moiety - Vinylogous amide - Enone - Alpha,beta-unsaturated ketone - Acryloyl-group - Ketene acetal or derivatives - Ketone - Carboxylic acid amidrazone - Carboxylic acid derivative - Azacycle - Sulfenyl compound - Amidine - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Hydrocarbon derivative - Amine - Organic oxide - Organic oxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as pyrazolones. These are compounds containing a pyrazole ring which bears a ketone.
External Descriptors
Not available