Structure Information
Structure

Compound Identification

SMILES

OCC1=CN=CC(=C1)C1=NN(C(C1)C1=C(O)C=CC=C1F)C(=O)C1=CN(C=N1)C1=CC2=C(CNCC2)C=C1

InChIKey

InChIKey=NTAJWKPEVFTBAP-UHFFFAOYSA-N

Formula

C28H25FN6O3

Mass

512.545

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Tetrahydroisoquinolines

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Tetrahydroisoquinolines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Tetrahydroisoquinoline - 3-fluorophenol - 3-halophenol - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Halobenzene - Fluorobenzene - Aralkylamine - Imidazole-4-carbonyl group - N-substituted imidazole - Aryl fluoride - Aryl halide - Pyridine - Monocyclic benzene moiety - Benzenoid - Pyrazoline - Heteroaromatic compound - Imidazole - Vinylogous amide - Azole - Amino acid or derivatives - Azacycle - Carboxylic acid derivative - Secondary aliphatic amine - Secondary amine - Primary alcohol - Organic nitrogen compound - Amine - Aromatic alcohol - Alcohol - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as tetrahydroisoquinolines. These are tetrahydrogenated isoquinoline derivatives.

External Descriptors

Not available

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