Compound Identification
SMILES
COC1=C(CCl)C=C(C=C1CCl)C1=C(CCl)C(=O)C2=CC=CC=C2S1
InChIKey
InChIKey=SCUIWZBARQMFQY-UHFFFAOYSA-N
Formula
C19H15Cl3O2S
Mass
413.74
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Benzothiopyrans
-
Subclass
1-benzothiopyrans
- Level 5 Thioflavones
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Subclass
1-benzothiopyrans
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Class
Benzothiopyrans
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzothiopyrans
Subclass
1-benzothiopyrans
Intermediate Tree Nodes
Not available
Direct Parent
Thioflavones
Alternative Parents
Thiochromenes Phenoxy compounds Methoxybenzenes Benzyl chlorides Anisoles Alkyl aryl ethers Heteroaromatic compounds Organochlorides Organic oxides Hydrocarbon derivatives Alkyl chlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenyl-4h-1-benzothiopyran-4-one - Thiochromene - Anisole - Phenol ether - Phenoxy compound - Benzyl chloride - Benzyl halide - Methoxybenzene - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Ether - Organic oxygen compound - Alkyl halide - Alkyl chloride - Organooxygen compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as thioflavones. These are organic compounds that contains the 2-phenyl-4H-1-benzothiopyran-4-one skeleton, which consists of a 1-benzothiopyran-4-one substituted at the 2-position by a phenyl group. These compounds are thio analogues of flavones.
External Descriptors
Not available