Compound Identification
SMILES
FC1=CC=C(C=C1)C1N(CCC#N)C(=S)NC2=C1C(=O)CCC2
InChIKey
InChIKey=OBICEJHRIJRPTK-UHFFFAOYSA-N
Formula
C17H16FN3OS
Mass
329.39
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
Pyrimidinethiones Fluorobenzenes Cyclohexenones 2-Thiopyrimidines Hydropyrimidines Aryl fluorides Vinylogous amides Thioureas Nitriles Azacyclic compounds Organofluorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Quinazoline - Pyrimidinethione - 2-thiopyrimidine - Halobenzene - Thiopyrimidine - Fluorobenzene - Cyclohexenone - 1,2,3,4-tetrahydropyrimidine - Hydropyrimidine - Pyrimidine - Aryl fluoride - Aryl halide - Benzenoid - Monocyclic benzene moiety - Vinylogous amide - Thiourea - Ketone - Carbonitrile - Azacycle - Nitrile - Organic nitrogen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Carbonyl group - 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