Compound Identification
SMILES
COC1=CC=C(C=C1)C1=NN=C(SCC2=CN3C=CC=CC3=N2)N1C[C@@H]1CCCO1
InChIKey
InChIKey=KLGOIWIVRKBNIB-IBGZPJMESA-N
Formula
C22H23N5O2S
Mass
421.52
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
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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
Imidazopyridines Imidazo[1,2-a]pyridines Phenoxy compounds Anisoles Methoxybenzenes Alkyl aryl ethers Alkylarylthioethers Pyridines and derivatives N-substituted imidazoles Oxolanes Heteroaromatic compounds Sulfenyl compounds Oxacyclic compounds Dialkyl ethers Azacyclic compounds Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenyl-1,2,4-triazole - Imidazopyridine - Imidazo[1,2-a]pyridine - Anisole - Phenol ether - Methoxybenzene - Aryl thioether - Phenoxy compound - Alkylarylthioether - Alkyl aryl ether - Pyridine - Monocyclic benzene moiety - Benzenoid - N-substituted imidazole - Heteroaromatic compound - Imidazole - Oxolane - Dialkyl ether - Ether - Oxacycle - Azacycle - Sulfenyl compound - Thioether - Hydrocarbon derivative - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - 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