Compound Identification
SMILES
CCO\C=C(/C(=O)C1CC1)C(=O)C1=C(Cl)C(CN2N=NN(C)C2=O)=C(C=C1)S(C)(=O)=O
InChIKey
InChIKey=FOBYCMTZLVVUDF-GXDHUFHOSA-N
Formula
C19H21ClN4O6S
Mass
468.91
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Butyrophenones
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Butyrophenones
Intermediate Tree Nodes
Not available
Direct Parent
Butyrophenones
Alternative Parents
Benzenesulfonyl compounds Aryl ketones Benzoyl derivatives Chlorobenzenes Alpha-branched alpha,beta-unsaturated ketones Aryl chlorides Vinylogous halides Vinylogous esters Tetrazoles Sulfones Acryloyl compounds Heteroaromatic compounds Enones Azacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Butyrophenone - Benzenesulfonyl group - Benzoyl - Aryl ketone - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Alpha-branched alpha,beta-unsaturated-ketone - Acryloyl-group - Azole - Heteroaromatic compound - Enone - Sulfone - Sulfonyl - Tetrazole - Alpha,beta-unsaturated ketone - Vinylogous ester - Vinylogous halide - Ketone - Azacycle - Organoheterocyclic compound - Organochloride - Organohalogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organic nitrogen compound - Organic oxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as butyrophenones. These are compounds containing 1-phenylbutan-1-one moiety.
External Descriptors
Not available