Structure Information
Structure

Compound Identification

SMILES

CCNc1cc(NC2=NC(=CN3C=C[C@@H](C)[C@H]4C[C@@]234)c2ccc3cn[nH]c3c2)ccc1N

InChIKey

InChIKey=CMOLIBPLFORSML-MJECEPGDSA-N

Formula

C25H27N7

Mass

425.54

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzopyrazoles

Subclass

Indazoles

Intermediate Tree Nodes

Not available

Direct Parent

Indazoles

Alternative Parents

Aniline and substituted anilines Phenylalkylamines Tetrahydropyridines Secondary alkylarylamines Aminopyrazines Azepines Imidolactams Pyrazoles Heteroaromatic compounds Trialkylamines Allylamines Propargyl-type 1,3-dipolar organic compounds Enamines Carboxamidines Azacyclic compounds Primary amines Hydrocarbon derivatives

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzopyrazole - Indazole - Phenylalkylamine - Aniline or substituted anilines - Aminopyrazine - Azepine - Secondary aliphatic/aromatic amine - Tetrahydropyridine - Monocyclic benzene moiety - Imidolactam - Benzenoid - Azole - Heteroaromatic compound - Pyrazole - Tertiary aliphatic amine - Tertiary amine - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allylamine - Amidine - Carboxylic acid amidine - Enamine - Azacycle - Secondary amine - Organic nitrogen compound - Amine - Organonitrogen compound - Primary amine - Hydrocarbon derivative - 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

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