Compound Identification
SMILES
COC1=CC=C(\C=C2/N=C(C)N(N3C(C)=NC4=C(C=C(I)C=C4)C3=O)C2=O)C=C1
InChIKey
InChIKey=SFPVAINEBMVBNA-GRSHGNNSSA-N
Formula
C21H17IN4O3
Mass
500.296
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Diazanaphthalenes
-
Subclass
Benzodiazines
- Level 5 Quinazolines
-
Subclass
Benzodiazines
-
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
Alpha amino acids and derivatives Phenoxy compounds Methoxybenzenes Anisoles Pyrimidones Alkyl aryl ethers Imidazolinones Aryl iodides Heteroaromatic compounds Lactams Amidrazones Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organoiodides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Quinazoline - Alpha-amino acid or derivatives - Phenoxy compound - Methoxybenzene - Phenol ether - Anisole - Pyrimidone - Alkyl aryl ether - Benzenoid - Pyrimidine - Imidazolinone - Monocyclic benzene moiety - Aryl iodide - Aryl halide - Heteroaromatic compound - 2-imidazoline - Lactam - Carboxylic acid amidrazone - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Ether - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organoiodide - Organohalogen compound - Carbonyl group - 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