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
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyridines and derivatives
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Subclass
Pyridyltriazoles
- Level 5 Pyridyl-1,2,4-triazoles
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Subclass
Pyridyltriazoles
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Class
Pyridines and derivatives
-
Superclass
Organoheterocyclic compounds
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
Benzamides Pyrrolopyridines Pyridinecarboxylic acids and derivatives N-acylpiperidines Aryl ketones Benzoyl derivatives Alkyl aryl ethers Aminopiperidines Bromobenzenes Methylpyridines Aryl bromides Substituted pyrroles Pyridinium derivatives Piperazines Vinylogous amides Heteroaromatic compounds Triazoles Tertiary carboxylic acid amides Amino acids and derivatives Trialkylamines Azacyclic compounds Hydrocarbon derivatives Organobromides Organic oxides Organic salts Organic cations
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