Compound Identification
SMILES
CC1=CC(=CC(C)=C1)N1C2=NN=C(SCCC#N)N2C2=CC=CC=C2C1=O
InChIKey
InChIKey=YIRHQQXVHYRMHH-UHFFFAOYSA-N
Formula
C20H17N5OS
Mass
375.45
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Diazanaphthalenes
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Subclass
Benzodiazines
- Level 5 Quinazolines
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Subclass
Benzodiazines
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Class
Diazanaphthalenes
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazanaphthalenes
Subclass
Benzodiazines
Intermediate Tree Nodes
Not available
Direct Parent
Quinazolines
Alternative Parents
Triazolopyrimidines m-Xylenes Pyrimidones Alkylarylthioethers Vinylogous amides Triazoles Heteroaromatic compounds Lactams Sulfenyl compounds Nitriles Azacyclic compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Quinazoline - Triazolopyrimidine - Aryl thioether - M-xylene - Xylene - Pyrimidone - Alkylarylthioether - Pyrimidine - Monocyclic benzene moiety - Benzenoid - Azole - Triazole - 1,2,4-triazole - Heteroaromatic compound - Vinylogous amide - Lactam - Carbonitrile - Nitrile - Sulfenyl compound - Thioether - Azacycle - Organic nitrogen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Cyanide - Organic oxygen compound - 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