Compound Identification
SMILES
COC1=CC=C(C=C1)C1=NN=C(SCC(=O)C2=NN=C(O2)C2=CC=C(Cl)C=C2)N1C1=CC=CC=C1C(C)C
InChIKey
InChIKey=RDDXMRQHGJIXET-UHFFFAOYSA-N
Formula
C28H24ClN5O3S
Mass
546.04
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
Phenylpropanes Cumenes Phenoxy compounds Anisoles Aryl alkyl ketones Methoxybenzenes Alkyl aryl ethers Alkylarylthioethers Chlorobenzenes Aryl chlorides 1,3,4-oxadiazoles Heteroaromatic compounds Azacyclic compounds Oxacyclic compounds Sulfenyl compounds Organic oxides Organochlorides Organonitrogen compounds Organopnictogen compounds Hydrocarbon derivatives Aldehydes
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenyl-1,2,4-triazole - Cumene - Phenylpropane - Anisole - Phenol ether - Phenoxy compound - Aryl thioether - Aryl ketone - Aryl alkyl ketone - Methoxybenzene - Alkylarylthioether - Chlorobenzene - Alkyl aryl ether - Halobenzene - Aryl halide - Aryl chloride - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - 1,3,4-oxadiazole - Oxadiazole - Ketone - Oxacycle - Azacycle - Sulfenyl compound - Thioether - Ether - Aldehyde - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organosulfur compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen 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