Compound Identification
SMILES
ClC1=CC=CC=C1C1=NN=C(SCCCC(=O)N2CCN(CC3=CC4=C(OCO4)C=C3)CC2)N1C1=CC=CC=C1
InChIKey
InChIKey=XPMZXQHSZLBZBJ-UHFFFAOYSA-N
Formula
C30H30ClN5O3S
Mass
576.11
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Azoles
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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
Benzodioxoles Alkylarylthioethers Aralkylamines Chlorobenzenes N-alkylpiperazines Aryl chlorides Tertiary carboxylic acid amides Heteroaromatic compounds Trialkylamines Amino acids and derivatives Oxacyclic compounds Azacyclic compounds Sulfenyl compounds Acetals Hydrocarbon derivatives Organopnictogen compounds Carbonyl compounds Organochlorides Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenyl-1,2,4-triazole - Benzodioxole - Aryl thioether - Chlorobenzene - Halobenzene - N-alkylpiperazine - Alkylarylthioether - Aralkylamine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - 1,4-diazinane - Piperazine - Benzenoid - Tertiary carboxylic acid amide - Heteroaromatic compound - Tertiary aliphatic amine - Tertiary amine - Amino acid or derivatives - Carboxamide group - Sulfenyl compound - Thioether - Acetal - Azacycle - Oxacycle - Carboxylic acid derivative - Organosulfur compound - Organic oxygen compound - Organopnictogen compound - Organohalogen compound - Carbonyl group - Organic nitrogen compound - Organochloride - Organic oxide - Hydrocarbon derivative - Amine - Organonitrogen compound - Organooxygen 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