Compound Identification
SMILES
CC(C)(C#N)C1=CC=C(CNC(=O)C2=C(F)C(Cl)=C(C=C2)S(=O)(=O)NC2=NC=C(F)S2)C=C1
InChIKey
InChIKey=OOYSOBUBJLBJTO-UHFFFAOYSA-N
Formula
C21H17ClF2N4O3S2
Mass
510.96
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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Subclass
Benzoic acids and derivatives
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Level 5
Benzamides
- Level 6 N-benzylbenzamides
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Level 5
Benzamides
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Subclass
Benzoic acids and derivatives
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Benzamides
Direct Parent
N-benzylbenzamides
Alternative Parents
2-halobenzoic acids and derivatives 3-halobenzoic acids and derivatives Benzenesulfonamides Phenylpropanes Benzenesulfonyl compounds Benzoyl derivatives 2,5-disubstituted thiazoles Chlorobenzenes Fluorobenzenes Organosulfonamides Aryl chlorides Aryl fluorides Vinylogous halides Aminosulfonyl compounds Heteroaromatic compounds Secondary carboxylic acid amides Azacyclic compounds Nitriles Organic oxides Organochlorides Organofluorides Organooxygen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-benzylbenzamide - Benzenesulfonamide - 2-halobenzoic acid or derivatives - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Phenylpropane - Benzenesulfonyl group - Benzoyl - 2,5-disubstituted 1,3-thiazole - Chlorobenzene - Fluorobenzene - Halobenzene - Aryl fluoride - Organosulfonic acid amide - Aryl chloride - Aryl halide - Heteroaromatic compound - Vinylogous halide - Thiazole - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Aminosulfonyl compound - Azole - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid derivative - Azacycle - Nitrile - Carbonitrile - Organoheterocyclic compound - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organofluoride - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Cyanide - Organic oxide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as n-benzylbenzamides. These are compounds containing a benzamide moiety that is N-linked to a benzyl group.
External Descriptors
Not available