Compound Identification
SMILES
C[NH+]1CCN(CC1)C(=O)C1=CC2=C(C=C1)C(=O)N(CC1=CC3=C(OCO3)C=C1)C(=S)N2
InChIKey
InChIKey=FFHDOJBTOPEDTM-UHFFFAOYSA-O
Formula
C22H23N4O4S
Mass
439.51
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
Benzodioxoles 2-Thiopyrimidines N-methylpiperazines Pyrimidinethiones Pyrimidones Benzenoids Heteroaromatic compounds Vinylogous amides Tertiary carboxylic acid amides Amino acids and derivatives Lactams Thioureas Trialkylamines Oxacyclic compounds Acetals Azacyclic compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Quinazoline - Benzodioxole - Pyrimidone - 2-thiopyrimidine - Thiopyrimidine - N-methylpiperazine - N-alkylpiperazine - Pyrimidinethione - 1,4-diazinane - Piperazine - Pyrimidine - Benzenoid - Tertiary carboxylic acid amide - Heteroaromatic compound - Vinylogous amide - Tertiary aliphatic amine - Thiourea - Amino acid or derivatives - Lactam - Carboxamide group - Tertiary amine - Acetal - Carboxylic acid derivative - Oxacycle - Azacycle - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Amine - Organopnictogen compound - Organic oxygen compound - Organosulfur compound - Organic nitrogen 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