Compound Identification
SMILES
CC(C)(C(=O)N1CCN(CC1)C(=O)C1=C(F)C=CC(CC2=NNC(=O)C3=CC=CC=C23)=C1)S(=O)C1=CC=C(F)C=C1
InChIKey
InChIKey=URNLEJDUANZFFY-UHFFFAOYSA-N
Formula
C30H28F2N4O4S
Mass
578.63
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
2-halobenzoic acids and derivatives Benzamides Phenyl sulfoxides Benzoyl derivatives Fluorobenzenes Pyridazinones Piperazines Aryl fluorides Heteroaromatic compounds Vinylogous halides Tertiary carboxylic acid amides Sulfoxides Lactams Tertiary amines Amino acids and derivatives Azacyclic compounds Sulfinyl compounds Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phthalazinone - 2-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Phenyl sulfoxide - Benzamide - Benzoic acid or derivatives - Benzoyl - Halobenzene - Fluorobenzene - Pyridazinone - Aryl fluoride - 1,4-diazinane - Aryl halide - Piperazine - Pyridazine - Monocyclic benzene moiety - Benzenoid - Tertiary carboxylic acid amide - Vinylogous halide - Heteroaromatic compound - Amino acid or derivatives - Carboxamide group - Lactam - Sulfoxide - Tertiary amine - Azacycle - Sulfinyl compound - Carboxylic acid derivative - Organooxygen compound - Carbonyl group - Organosulfur compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organofluoride - Organohalogen 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