Compound Identification
SMILES
O=C(CCC(=O)C1=CC=CS1)OCC1=NC2=CC=CC=C2C(=O)N1CC#N
InChIKey
InChIKey=IUOVAPXKMJAYKD-UHFFFAOYSA-N
Formula
C19H15N3O4S
Mass
381.41
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Diazanaphthalenes
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Subclass
Benzodiazines
- Level 5 Quinazolines
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Subclass
Benzodiazines
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Class
Diazanaphthalenes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazanaphthalenes
Subclass
Benzodiazines
Intermediate Tree Nodes
Not available
Direct Parent
Quinazolines
Alternative Parents
Gamma-keto acids and derivatives Aryl alkyl ketones Pyrimidones Fatty acid esters Benzenoids Thiophenes Heteroaromatic compounds Lactams Carboxylic acid esters Nitriles Monocarboxylic acids and derivatives Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Quinazoline - Gamma-keto acid - Aryl ketone - Aryl alkyl ketone - Fatty acid ester - Pyrimidone - Keto acid - Pyrimidine - Benzenoid - Fatty acyl - Thiophene - Heteroaromatic compound - Carboxylic acid ester - Ketone - Lactam - Carboxylic acid derivative - Azacycle - Nitrile - Carbonitrile - Monocarboxylic acid or derivatives - Organic oxide - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Cyanide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as quinazolines. These are compounds containing a quinazoline moiety, which is made up of two fused six-member aromatic rings, a benzene ring and a pyrimidine ring.
External Descriptors
Not available