Compound Identification
SMILES
COC1=C(OC)C=C(C=C1)C1=NN2C(SC(=CC3=CN(N=C3C3=CC=C(C)C=C3)C3=CC=CC=C3)C2=O)=N1
InChIKey
InChIKey=XMKZZMKQELHHQK-UHFFFAOYSA-N
Formula
C29H23N5O3S
Mass
521.6
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
Pyrazoles
- Level 5 Phenylpyrazoles
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Subclass
Pyrazoles
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Class
Azoles
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azoles
Subclass
Pyrazoles
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrazoles
Alternative Parents
Phenyl-1,2,4-triazoles Dimethoxybenzenes Triazolothiazoles Phenoxy compounds Anisoles Toluenes Alkyl aryl ethers Thiazoles Heteroaromatic compounds Lactams Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylpyrazole - Phenyl-1,2,4-triazole - Phenyltriazole - O-dimethoxybenzene - Dimethoxybenzene - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Triazolothiazole - Alkyl aryl ether - Toluene - Monocyclic benzene moiety - Benzenoid - Thiazole - 1,2,4-triazole - Triazole - Heteroaromatic compound - Lactam - Ether - Azacycle - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Organooxygen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpyrazoles. These are compounds containing a phenylpyrazole skeleton, which consists of a pyrazole bound to a phenyl group.
External Descriptors
Not available