Compound Identification
SMILES
CC(=O)CC(=O)NN1C(=O)C2=C(C=CC(I)=C2)N=C1C1=CC=CS1
InChIKey
InChIKey=JZKVQELXNJUCSY-UHFFFAOYSA-N
Formula
C16H12IN3O3S
Mass
453.25
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
Pyrimidones Benzenoids Aryl iodides 1,3-dicarbonyl compounds Thiophenes Heteroaromatic compounds Lactams Ketones Carboxylic acids and derivatives Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organoiodides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Quinazoline - Pyrimidone - Aryl halide - Aryl iodide - Pyrimidine - 1,3-dicarbonyl compound - Benzenoid - Thiophene - Heteroaromatic compound - Lactam - Ketone - Carboxylic acid derivative - Azacycle - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Organoiodide - Organohalogen compound - Carbonyl group - Organic oxygen compound - Organic nitrogen 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