Compound Identification
SMILES
O[C@@H](CC1=CC=C(F)C=C1)\C=C\[C@H]1CCC(=O)N1CCCC1=CC=C(S1)C1=NNN=N1
InChIKey
InChIKey=IWUSCURTJFCRHJ-XJMNNFRSSA-N
Formula
C22H24FN5O2S
Mass
441.53
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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Subclass
Halobenzenes
- Level 5 Fluorobenzenes
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Subclass
Halobenzenes
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Class
Benzene and substituted derivatives
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Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Halobenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Fluorobenzenes
Alternative Parents
2,5-disubstituted thiophenes Pyrrolidine-2-ones N-alkylpyrrolidines Aryl fluorides Tetrazoles Tertiary carboxylic acid amides Heteroaromatic compounds Secondary alcohols Lactams Azacyclic compounds Organonitrogen compounds Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Fluorobenzene - 2,5-disubstituted thiophene - Aryl fluoride - Aryl halide - Pyrrolidone - 2-pyrrolidone - N-alkylpyrrolidine - Heteroaromatic compound - Azole - Thiophene - Tetrazole - Tertiary carboxylic acid amide - Pyrrolidine - Secondary alcohol - Carboxamide group - Lactam - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organic oxide - Organohalogen compound - Organofluoride - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Carbonyl group - Alcohol - Organic oxygen compound - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as fluorobenzenes. These are compounds containing one or more fluorine atoms attached to a benzene ring.
External Descriptors
Not available