Compound Identification
SMILES
CCN(CC)CCCC(C)NC(=O)C1=COC(CSC2=NN=C(N2C2=CC=CC=C2)C2=CC=CC=C2Cl)=N1
InChIKey
InChIKey=XHVKVBWTQKWHQN-UHFFFAOYSA-N
Formula
C28H33ClN6O2S
Mass
553.12
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
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
2-heteroaryl carboxamides 2,4-disubstituted oxazoles Alkylarylthioethers Chlorobenzenes Aryl chlorides Heteroaromatic compounds Trialkylamines Secondary carboxylic acid amides Amino acids and derivatives Sulfenyl compounds Oxacyclic compounds Azacyclic compounds Organochlorides Organic oxides Organooxygen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenyl-1,2,4-triazole - 2-heteroaryl carboxamide - Aryl thioether - 2,4-disubstituted 1,3-oxazole - Halobenzene - Alkylarylthioether - Chlorobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Oxazole - Heteroaromatic compound - Tertiary aliphatic amine - Carboxamide group - Tertiary amine - Secondary carboxylic acid amide - Amino acid or derivatives - Oxacycle - Azacycle - Carboxylic acid derivative - Sulfenyl compound - Thioether - Organic oxide - Organic oxygen compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organohalogen compound - Organochloride - 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