Structure Information
Structure

Compound Identification

SMILES

CC1(C)CN(CCO1)C1=NC(=NC(=N1)N1CCOCC1)N1C(=NC2=C1C=CC(=C2)[N+]([O-])=O)C(F)F

InChIKey

InChIKey=JJEWNUPUCJERIT-UHFFFAOYSA-N

Formula

C21H24F2N8O4

Mass

490.472

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzimidazoles

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Benzimidazoles

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzimidazole - 2,4-diamine-s-triazine - Nitroaromatic compound - Dialkylarylamine - Amino-1,3,5-triazine - Aminotriazine - Morpholine - N-substituted imidazole - Oxazinane - Triazine - Benzenoid - 1,3,5-triazine - Heteroaromatic compound - Azole - Imidazole - Organic nitro compound - C-nitro compound - Allyl-type 1,3-dipolar organic compound - Azacycle - Organic 1,3-dipolar compound - Dialkyl ether - Ether - Propargyl-type 1,3-dipolar organic compound - Organic oxoazanium - Oxacycle - Organic oxygen compound - Organic nitrogen compound - Organohalogen compound - Alkyl halide - Alkyl fluoride - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic oxide - Amine - Hydrocarbon derivative - Organic salt - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as benzimidazoles. These are organic compounds containing a benzene ring fused to an imidazole ring (five member ring containing a nitrogen atom, 4 carbon atoms, and two double bonds).

External Descriptors

Not available

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