Compound Identification
SMILES
COC1=CC=CC=C1C(=O)NNC(=O)C1=CSC(=N1)C1CCN(CC1)C(=O)C1=C(C)N(N=C1)C1=CC=CC=C1
InChIKey
InChIKey=KVJKUBWMWXCGPH-UHFFFAOYSA-N
Formula
C28H28N6O4S
Mass
544.63
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Azoles
-
Subclass
Pyrazoles
- Level 5 Phenylpyrazoles
-
Subclass
Pyrazoles
-
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
Benzoic acids and derivatives N-acylpiperidines Anisoles Benzoyl derivatives Methoxybenzenes Thiazolecarboxamides Phenoxy compounds Pyrazole-4-carboxamides 2,4-disubstituted thiazoles Alkyl aryl ethers Heteroaromatic compounds Vinylogous amides Tertiary carboxylic acid amides Carboxylic acid hydrazides Azacyclic compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylpyrazole - N-acyl-piperidine - Benzoic acid or derivatives - Phenoxy compound - Anisole - Pyrazole-4-carboxamide - Benzoyl - Methoxybenzene - Phenol ether - Thiazolecarboxamide - Thiazolecarboxylic acid or derivatives - 2,4-disubstituted 1,3-thiazole - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Piperidine - Vinylogous amide - Heteroaromatic compound - Tertiary carboxylic acid amide - Thiazole - Carboxylic acid hydrazide - Carboxamide group - Azacycle - Carboxylic acid derivative - Ether - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organic oxygen compound - Organic oxide - 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