Compound Identification
SMILES
CN1C(=O)N(C2CCN(CCCN3N=C(C4=C3CCN(C4)S(=O)(=O)CC3=CC=CC=C3)C3=CC=C(Br)C=C3)CC2)C2=CC=CC=C12
InChIKey
InChIKey=GRGJAGRKRJZQIX-UHFFFAOYSA-N
Formula
C35H39BrN6O3S
Mass
703.7
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
Benzimidazoles Bromobenzenes Aryl bromides N-substituted imidazoles Organic sulfonamides Organosulfonamides Piperidines Heteroaromatic compounds Sulfonyls Ureas Trialkylamines Azacyclic compounds Organic oxides Hydrocarbon derivatives Organobromides Organooxygen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylpyrazole - Benzimidazole - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - N-substituted imidazole - Piperidine - Organic sulfonic acid amide - Organosulfonic acid amide - Heteroaromatic compound - Imidazole - Organic sulfonic acid or derivatives - Sulfonyl - Organosulfonic acid or derivatives - Urea - Tertiary aliphatic amine - Tertiary amine - Azacycle - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Amine - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Aromatic heteropolycyclic 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