Compound Identification
SMILES
ClC1=CC2=C1C=C2.COC1=C(OC)C=C(C=C1)C1=COC(=N1)C(S)C(O)=O
InChIKey
InChIKey=XKWAAGNWIGMSPJ-UHFFFAOYSA-N
Formula
C19H16ClNO5S
Mass
405.85
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Azoles
-
Subclass
Oxazoles
- Level 5 Phenyl-1,3-oxazoles
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Subclass
Oxazoles
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Class
Azoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azoles
Subclass
Oxazoles
Intermediate Tree Nodes
Not available
Direct Parent
Phenyl-1,3-oxazoles
Alternative Parents
Dimethoxybenzenes Phenoxy compounds Anisoles 2,4-disubstituted oxazoles Alkyl aryl ethers Aryl chlorides alpha-Mercaptocarboxylic acids Heteroaromatic compounds Oxacyclic compounds Azacyclic compounds Alkylthiols Monocarboxylic acids and derivatives Organic oxides Carbonyl compounds Organochlorides Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
Phenyl-1,3-oxazole - Dimethoxybenzene - O-dimethoxybenzene - Phenol ether - Phenoxy compound - Methoxybenzene - Anisole - 2,4-disubstituted 1,3-oxazole - Alkyl aryl ether - Benzenoid - Aryl chloride - Aryl halide - Monocyclic benzene moiety - 2-mercaptocarboxylic acid - Heteroaromatic compound - Oxacycle - Azacycle - Carboxylic acid - Monocarboxylic acid or derivatives - Ether - Carboxylic acid derivative - Alkylthiol - Organic nitrogen compound - Organohalogen compound - Organochloride - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenyl-1,3-oxazoles. These are aromatic heterocyclic compounds containing a 1,3-oxazole substituted at one or more positions by a phenyl group.
External Descriptors
Not available