Compound Identification
SMILES
Cc1cc(CNC(=O)c2cc(C(=O)NCc3ccc4OCC(=O)Nc4c3)n3c(n[nH]c3=S)n2)ccc1C(O)=O
InChIKey
InChIKey=BVNZUOOTEOUSCB-UHFFFAOYSA-N
Formula
C25H21N7O6S
Mass
547.55
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Benzoxazines
- Subclass Benzoxazinones
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Class
Benzoxazines
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzoxazines
Subclass
Benzoxazinones
Intermediate Tree Nodes
Not available
Direct Parent
Benzoxazinones
Alternative Parents
Benzomorpholines Triazolopyrimidines Benzoic acids Pyrimidinecarboxylic acids and derivatives 2-heteroaryl carboxamides Benzoyl derivatives Alkyl aryl ethers Toluenes Heteroaromatic compounds Triazoles Lactams Secondary carboxylic acid amides Carboxylic acids Azacyclic compounds Oxacyclic compounds Organosulfur compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoxazinone - Benzomorpholine - Benzoic acid or derivatives - Benzoic acid - Pyrimidine-6-carboxylic acid or derivatives - Triazolopyrimidine - 2-heteroaryl carboxamide - Benzoyl - Alkyl aryl ether - Toluene - Benzenoid - Monocyclic benzene moiety - Oxazinane - Pyrimidine - Azole - Heteroaromatic compound - Triazole - 1,2,4-triazole - Carboxamide group - Lactam - Secondary carboxylic acid amide - Carboxylic acid - Oxacycle - Carboxylic acid derivative - Azacycle - Ether - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzoxazinones. These are organic compounds containing a benzene fused to an oxazine ring (a six-member aliphatic ring with four carbon atoms, one oxygen atom, and one nitrogen atom) bearing a ketone group.
External Descriptors
Not available