Compound Identification
SMILES
COC1=C(OC(F)F)C=CC(C=C2SC3=NC4=C(CCCC4=CC4=CC=C(C=C4)N(C)C)C(N3C2=O)C2=CC=C(C=C2)N(C)C)=C1
InChIKey
InChIKey=QEZJCHZWBQAZNB-UHFFFAOYSA-N
Formula
C36H36F2N4O3S
Mass
642.77
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
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Class
Diarylheptanoids
- Subclass Linear diarylheptanoids
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Class
Diarylheptanoids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Diarylheptanoids
Subclass
Linear diarylheptanoids
Intermediate Tree Nodes
Not available
Direct Parent
Linear diarylheptanoids
Alternative Parents
Quinazolines Phenoxy compounds Aniline and substituted anilines Methoxybenzenes Anisoles Dialkylarylamines Alkyl aryl ethers Thiazoles Heteroaromatic compounds Lactams Isothioureas Azacyclic compounds Hydrocarbon derivatives Organic oxides Alkyl fluorides Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Linear 1,7-diphenylheptane skeleton - Quinazoline - Anisole - Phenol ether - Phenoxy compound - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Methoxybenzene - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Thiazole - Heteroaromatic compound - Azole - Tertiary amine - Isothiourea - Lactam - Organoheterocyclic compound - Azacycle - Ether - Organic oxygen compound - Organic nitrogen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Alkyl fluoride - Alkyl halide - Amine - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as linear diarylheptanoids. These are diarylheptanoids with an open heptane chain. The two aromatic rings are linked only by the heptane chain.
External Descriptors
Not available