Compound Identification
SMILES
FC1=CC=C(C=C1)C1=CSC2=NC3=C(CCCC3=CC3=CC=CC=C3Cl)C(N12)C1=CC=CC=C1Cl
InChIKey
InChIKey=MGEJAWQHHIAJIO-UHFFFAOYSA-N
Formula
C29H21Cl2FN2S
Mass
519.46
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
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 Chlorobenzenes Fluorobenzenes Aryl chlorides Aryl fluorides Hydropyrimidines Thiazoles Thiazolines Isothioureas Azacyclic compounds Enamines Carboximidamides Propargyl-type 1,3-dipolar organic compounds Hydrocarbon derivatives Organochlorides Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Linear 1,7-diphenylheptane skeleton - Quinazoline - Chlorobenzene - Fluorobenzene - Halobenzene - Aryl chloride - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Hydropyrimidine - 1,6-dihydropyrimidine - Meta-thiazoline - Thiazole - Isothiourea - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Enamine - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Hydrocarbon derivative - Organic nitrogen compound - Amine - Organonitrogen compound - Organofluoride - Organochloride - Organohalogen compound - 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