Compound Identification
SMILES
CN1N=CC(C(=O)N[C@@H]2CCOC2)=C1C(=O)NC1=CC2=NC(=NN2C=C1)C1=CC=CC=C1
InChIKey
InChIKey=XWLIMFCSOQTQLT-MRXNPFEDSA-N
Formula
C22H21N7O3
Mass
431.456
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Azoles
-
Subclass
Triazoles
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Level 5
Phenyltriazoles
- Level 6 Phenyl-1,2,4-triazoles
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Level 5
Phenyltriazoles
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Subclass
Triazoles
-
Class
Azoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azoles
Subclass
Triazoles
Intermediate Tree Nodes
Phenyltriazoles
Direct Parent
Phenyl-1,2,4-triazoles
Alternative Parents
Triazolopyridines 2-heteroaryl carboxamides Pyrazole-5-carboxamides Pyrazole-4-carboxamides Benzene and substituted derivatives Pyridines and derivatives Vinylogous amides Heteroaromatic compounds Oxolanes Secondary carboxylic acid amides Azacyclic compounds Dialkyl ethers Oxacyclic compounds Organic oxides Hydrocarbon derivatives Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenyl-1,2,4-triazole - Triazolopyridine - 2-heteroaryl carboxamide - Pyrazole-5-carboxamide - Pyrazole-4-carboxamide - Monocyclic benzene moiety - Pyridine - Benzenoid - Oxolane - Pyrazole - Heteroaromatic compound - Vinylogous amide - Carboxamide group - Secondary carboxylic acid amide - Ether - Dialkyl ether - Carboxylic acid derivative - Oxacycle - Azacycle - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenyl-1,2,4-triazoles. These are organic compounds containing a 1,2,4-triazole substituted by a phenyl group.
External Descriptors
Not available