Structure Information
Structure

Compound Identification

SMILES

CC1=NC(C)=C(C#N)[C@H]([C@@H]1C#N)C1=CC2=C(CNC3=CN=CC=C3)NN=C2C=C1

InChIKey

InChIKey=IRNLBWMAGZWOKD-GCJKJVERSA-N

Formula

C22H19N7

Mass

381.443

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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

Secondary alkylarylamines Dihydropyridines Aralkylamines Aminopyridines and derivatives Benzenoids Pyrazoles Heteroaromatic compounds Ketimines Propargyl-type 1,3-dipolar organic compounds Nitriles Azacyclic compounds Hydrocarbon derivatives

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzopyrazole - Indazole - Aminopyridine - Dihydropyridine - Aralkylamine - Secondary aliphatic/aromatic amine - Hydropyridine - Pyridine - Benzenoid - Azole - Heteroaromatic compound - Pyrazole - Ketimine - Nitrile - Carbonitrile - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Secondary amine - Organonitrogen compound - Imine - Organic nitrogen compound - Hydrocarbon derivative - Cyanide - 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

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