Compound Identification
SMILES
C[C@H]1CCCN(C1)C(=O)CSC1=NN=C(N1C[C@H]1CCCO1)C1=CC=C(F)C=C1
InChIKey
InChIKey=XLOINJFTMHJNHS-MAUKXSAKSA-N
Formula
C21H27FN4O2S
Mass
418.53
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
N-acylpiperidines Alkylarylthioethers Fluorobenzenes Aryl fluorides Tertiary carboxylic acid amides Oxolanes Heteroaromatic compounds Tertiary amines Amino acids and derivatives Sulfenyl compounds Oxacyclic compounds Dialkyl ethers Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organofluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenyl-1,2,4-triazole - N-acyl-piperidine - Aryl thioether - Halobenzene - Alkylarylthioether - Fluorobenzene - Piperidine - Benzenoid - Aryl fluoride - Monocyclic benzene moiety - Aryl halide - Oxolane - Tertiary carboxylic acid amide - Heteroaromatic compound - Carboxamide group - Tertiary amine - Amino acid or derivatives - Oxacycle - Carboxylic acid derivative - Dialkyl ether - Ether - Azacycle - Sulfenyl compound - Thioether - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - Carbonyl group - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Aromatic heteromonocyclic 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