Compound Identification
SMILES
COC1=C(C=C(NC(=O)CN2NC(=O)C3=CC=CC=C3C2=O)C=C1)S(=O)(=O)N1CCOCC1
InChIKey
InChIKey=GJGJGUCRTGUGBY-UHFFFAOYSA-N
Formula
C21H22N4O7S
Mass
474.49
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
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Level 5
Phthalazines
- Level 6 Phthalazinones
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Level 5
Phthalazines
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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
Phthalazines
Direct Parent
Phthalazinones
Alternative Parents
Benzenesulfonamides Anilides Benzenesulfonyl compounds Methoxyanilines Phenoxy compounds N-arylamides Methoxybenzenes Anisoles Pyridazinones Alkyl aryl ethers Organosulfonamides Morpholines Sulfonyls Heteroaromatic compounds Secondary carboxylic acid amides Lactams Oxacyclic compounds Dialkyl ethers Azacyclic compounds Carbonyl compounds Organic oxides Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phthalazinone - Benzenesulfonamide - Anilide - Methoxyaniline - Benzenesulfonyl group - N-arylamide - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - Pyridazinone - Benzenoid - Pyridazine - Organosulfonic acid amide - Oxazinane - Morpholine - Monocyclic benzene moiety - Organic sulfonic acid or derivatives - Sulfonyl - Organosulfonic acid or derivatives - Heteroaromatic compound - Carboxamide group - Lactam - Secondary carboxylic acid amide - Ether - Dialkyl ether - Carboxylic acid derivative - Oxacycle - Azacycle - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organic oxide - Organopnictogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phthalazinones. These are compounds containing a phthalazine bearing a ketone group.
External Descriptors
Not available