Compound Identification
SMILES
CC1=C(C=NN1C1=CC=CC=C1)C(\O)=C1/C(N(CC2=CN=CC=C2)C(=O)C1=O)C1=CC=CS1
InChIKey
InChIKey=BBWVHPRMHPMXQX-LNVKXUELSA-N
Formula
C25H20N4O3S
Mass
456.52
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Azoles
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Subclass
Pyrazoles
- Level 5 Phenylpyrazoles
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Subclass
Pyrazoles
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Class
Azoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azoles
Subclass
Pyrazoles
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrazoles
Alternative Parents
Benzene and substituted derivatives N-alkylpyrrolidines Pyridines and derivatives Pyrrolidine-3-ones Pyrrolidine-2-ones Vinylogous acids Heteroaromatic compounds Thiophenes Tertiary carboxylic acid amides Lactams Cyclic ketones Azacyclic compounds Enols Hydrocarbon derivatives Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylpyrazole - Monocyclic benzene moiety - Pyridine - Pyrrolidone - 2-pyrrolidone - 3-pyrrolidone - N-alkylpyrrolidine - Benzenoid - Pyrrolidine - Heteroaromatic compound - Tertiary carboxylic acid amide - Thiophene - Vinylogous acid - Lactam - Ketone - Carboxamide group - Cyclic ketone - Enol - Azacycle - Carboxylic acid derivative - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Carbonyl group - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpyrazoles. These are compounds containing a phenylpyrazole skeleton, which consists of a pyrazole bound to a phenyl group.
External Descriptors
Not available