Compound Identification
SMILES
COC1=C(C)N=C(O1)C1=CCC2(SCCS2)C1(C)C(=O)\C=C\C
InChIKey
InChIKey=WTTFFLPFFDCTNQ-AATRIKPKSA-N
Formula
C17H21NO3S2
Mass
351.48
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Azoles
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Subclass
Oxazoles
- Level 5 2,4,5-trisubstituted 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
2,4,5-trisubstituted oxazoles
Alternative Parents
Dithioketals Alkyl aryl ethers Heteroaromatic compounds Enones Acryloyl compounds 1,3-dithiolanes Ketones Oxacyclic compounds Dialkylthioethers Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2,4,5-trisubstituted 1,3-oxazole - Alkyl aryl ether - Dithioketal - Acryloyl-group - Thioacetal - Heteroaromatic compound - Dithiolane - Enone - Alpha,beta-unsaturated ketone - 1,3-dithiolane - Ketone - Oxacycle - Azacycle - Dialkylthioether - Ether - Thioether - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 2,4,5-trisubstituted oxazoles. These are compounds containing an oxazole ring substituted at positions 2, 4 and 5 only. Oxazole is a five-membered aromatic heterocycle with one oxygen, one nitrogen, and three carbon atoms. Isomers include 1,2-oxazole and 1,3-oxazole.
External Descriptors
Not available