Structure Information
Structure

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

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Azoles

Subclass

Triazoles

Intermediate Tree Nodes

Phenyltriazoles

Direct Parent

Phenyl-1,2,4-triazoles

Alternative Parents

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

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