Compound Identification
SMILES
C[C@H](OC(=O)CSC1=C(C#N)C(C)=CC(=O)N1)C1=NC(=O)C2=CC=CC=C2N1
InChIKey
InChIKey=YNYJKVURZKNWRA-NSHDSACASA-N
Formula
C19H16N4O4S
Mass
396.42
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
3-pyridinecarbonitriles Pyrimidones Pyridinones Methylpyridines Alkylarylthioethers Dihydropyridines Benzenoids Vinylogous amides Heteroaromatic compounds Lactams Carboxylic acid esters Sulfenyl compounds Nitriles Monocarboxylic acids and derivatives Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Quinazoline - Aryl thioether - 3-pyridinecarbonitrile - Dihydropyridine - Methylpyridine - Pyridinone - Alkylarylthioether - Pyrimidone - Hydropyridine - Pyridine - Benzenoid - Pyrimidine - Heteroaromatic compound - Vinylogous amide - Carboxylic acid ester - Lactam - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Azacycle - Sulfenyl compound - Thioether - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxygen compound - Cyanide - Organic oxide - 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