Compound Identification
SMILES
COC1=C(OC)C=C(C=C1)C1N2NC(SCC3=CC(=CC=C3)[N+]([O-])=O)=NC2=NC2=C1C(=O)CCC2
InChIKey
InChIKey=DYMHDGIYUIXNJR-UHFFFAOYSA-N
Formula
C24H23N5O5S
Mass
493.54
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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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
Dimethoxybenzenes Nitrobenzenes Phenoxy compounds Nitroaromatic compounds Anisoles Alkyl aryl ethers Cyclohexenones Hydropyrimidines Triazolines Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Azacyclic compounds Sulfenyl compounds Organic zwitterions Organic salts Organic oxides Imines Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
O-dimethoxybenzene - Dimethoxybenzene - Quinazoline - Nitrobenzene - Phenoxy compound - Nitroaromatic compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - Cyclohexenone - Monocyclic benzene moiety - Hydropyrimidine - 1,6-dihydropyrimidine - Benzenoid - Triazoline - Ketone - C-nitro compound - Organic nitro compound - Sulfenyl compound - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Ether - Azacycle - Organic oxoazanium - Organic salt - Organic oxygen compound - Organic nitrogen compound - Imine - Organonitrogen compound - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Organic oxide - Organic zwitterion - Organosulfur 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