Compound Identification
SMILES
CCCCN1[C@H](CC2=CC(C)=CC(C)=C2)[C@H](O)[C@@H](O)[C@@H](CC2=CC(C)=CC(C)=C2)N(CC2=CC3=C(NN=C3N)C=C2)C1=O
InChIKey
InChIKey=YBOQWURBTADCQS-FYZVQMPESA-N
Formula
C35H45N5O3
Mass
583.777
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Benzopyrazoles
- Subclass Indazoles
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Class
Benzopyrazoles
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzopyrazoles
Subclass
Indazoles
Intermediate Tree Nodes
Not available
Direct Parent
Indazoles
Alternative Parents
m-Xylenes 1,3-diazepanes Imidolactams Pyrazoles Heteroaromatic compounds Ureas Tertiary amines Secondary alcohols 1,2-diols Azacyclic compounds Primary amines Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzopyrazole - Indazole - M-xylene - Xylene - 1,3-diazepane - Diazepane - Monocyclic benzene moiety - Benzenoid - Imidolactam - Azole - Heteroaromatic compound - Pyrazole - Secondary alcohol - 1,2-diol - Tertiary amine - Urea - Azacycle - Alcohol - Primary amine - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen compound - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as indazoles. These are compounds containing an indazole, which is structurally characterized by a pyrazole fused to a benzene.
External Descriptors
Not available