Compound Identification
SMILES
CCN1NC=C(C(=O)C2=C(Cl)C(N3CCC=CC3)=C(C=C2)S(C)(=O)=O)C1=O
InChIKey
InChIKey=HPNXZMICAWMSHY-UHFFFAOYSA-N
Formula
C18H20ClN3O4S
Mass
409.89
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Benzoyl derivatives
- Level 5 Benzoylpyrazoles
-
Subclass
Benzoyl derivatives
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoyl derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Benzoylpyrazoles
Alternative Parents
Aryl-phenylketones Benzenesulfonyl compounds Aniline and substituted anilines Dialkylarylamines Chlorobenzenes Aryl chlorides Pyrazolones Hydropyridines Vinylogous amides Heteroaromatic compounds Pyrazoles Vinylogous halides Sulfones Lactams Azacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzoylpyrazole - Aryl-phenylketone - Benzenesulfonyl group - Tertiary aliphatic/aromatic amine - Aryl ketone - Dialkylarylamine - Aniline or substituted anilines - Halobenzene - Chlorobenzene - Pyrazolinone - Hydropyridine - Aryl chloride - Aryl halide - Heteroaromatic compound - Sulfonyl - Vinylogous amide - Vinylogous halide - Sulfone - Pyrazole - Azole - Ketone - Lactam - Tertiary amine - Organoheterocyclic compound - Azacycle - Organonitrogen compound - Organochloride - Organohalogen compound - Amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzoylpyrazoles. These are aromatic compounds containing a benzoyl group substituted with a pyrazole ring.
External Descriptors
Not available