Compound Identification
SMILES
COC1=CC=CC=C1C1=NN=C2N1N=C(\C2=C\C1=CC=C(S1)N(C)C)C(C)(C)C.COC1=CC(OC)=C(C=C1)C1=NN=C2N1N=C(\C2=C\C1=CC=C(S1)N(C)C)C(C)(C)C
InChIKey
InChIKey=BQMSDZHZIWNCHN-SHFRCFMGSA-N
Formula
C45H52N10O3S2
Mass
845.1
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
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
Dimethoxybenzenes Phenoxy compounds Dialkylarylamines Anisoles Alkyl aryl ethers 2,5-disubstituted thiophenes 2-aminothiophenes Pyrazoles Heteroaromatic compounds Azacyclic compounds Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
Phenyl-1,2,4-triazole - Dimethoxybenzene - M-dimethoxybenzene - Anisole - Phenoxy compound - Phenol ether - Dialkylarylamine - Methoxybenzene - Alkyl aryl ether - 2,5-disubstituted thiophene - Benzenoid - Monocyclic benzene moiety - 2-aminothiophene - Heteroaromatic compound - Thiophene - Pyrazole - Tertiary amine - Ether - Azacycle - Amine - Hydrocarbon derivative - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen 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