Structure Information
Structure

Compound Identification

SMILES

COC1=CN=C(N2C=NC(C)=N2)C2=C1C(=CN2)C(=O)C(=O)N1CCN(CC1)C(=O)C1=CC=CC=C1.CCO\N=C(\C1CCN(CC1)C1(C)CCN(CC1)C(=O)C1=C(C)C=C[N+]([O-])=C1C)C1=CC=C(Br)C=C1

InChIKey

InChIKey=OVSUIYYZSUPVBU-REAKUJNMSA-N

Formula

C52H60BrN11O7

Mass

1031.026

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Pyridines and derivatives

Subclass

Pyridyltriazoles

Intermediate Tree Nodes

Not available

Direct Parent

Pyridyl-1,2,4-triazoles

Alternative Parents

Molecular Framework

Not available

Substituents

Pyridyl-1,2,4-triazole - Benzamide - Benzoic acid or derivatives - N-acyl-piperidine - Pyridine carboxylic acid or derivatives - Pyrrolopyridine - Benzoyl - Aryl ketone - Alkyl aryl ether - 4-aminopiperidine - Bromobenzene - Halobenzene - Methylpyridine - 1,4-diazinane - Monocyclic benzene moiety - Aryl halide - Aryl bromide - Benzenoid - Piperazine - Piperidine - Pyridinium - Substituted pyrrole - Vinylogous amide - Azole - Pyrrole - Heteroaromatic compound - Tertiary carboxylic acid amide - Triazole - 1,2,4-triazole - Ketone - Carboxamide group - Amino acid or derivatives - Tertiary amine - Tertiary aliphatic amine - Ether - Azacycle - Carboxylic acid derivative - Organic salt - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen compound - Amine - Organic nitrogen compound - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as pyridyl-1,2,4-triazoles. These are organic compounds containing a pyridine ring attached to a 1,2,4-triazole ring.

External Descriptors

Not available

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