Compound Identification
SMILES
O=C(CSC1=NC2=CC=CC=C2C2=NC(CC[NH+]3CCCCC3)=NN12)NCC1=CC=CC=C1
InChIKey
InChIKey=AHBXXLCWMRHTOD-UHFFFAOYSA-O
Formula
C25H29N6OS
Mass
461.61
Taxonomic Classification
Taxonomy Tree
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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
Triazolopyrimidines Alkylarylthioethers Aralkylamines Benzene and substituted derivatives Pyrimidines and pyrimidine derivatives Piperidines Triazoles Quaternary ammonium salts Heteroaromatic compounds Trialkylamines Amino acids and derivatives Secondary carboxylic acid amides Sulfenyl compounds Azacyclic compounds Carbonyl compounds Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Quinazoline - Triazolopyrimidine - Aryl thioether - Aralkylamine - Alkylarylthioether - Monocyclic benzene moiety - Pyrimidine - Benzenoid - Piperidine - Triazole - 1,2,4-triazole - Azole - Quaternary ammonium salt - Heteroaromatic compound - Tertiary amine - Amino acid or derivatives - Tertiary aliphatic amine - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid derivative - Azacycle - Sulfenyl compound - Thioether - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Amine - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Organic cation - 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