Compound Identification
SMILES
COC1=CC=C(C=C1)C(=O)OCC#CCSC1=NN=NN1C1=CC=CC=C1OC
InChIKey
InChIKey=FXOFRZQNFXWNOZ-UHFFFAOYSA-N
Formula
C20H18N4O4S
Mass
410.45
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Azoles
-
Subclass
Tetrazoles
- Level 5 Phenyltetrazoles and derivatives
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Subclass
Tetrazoles
-
Class
Azoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azoles
Subclass
Tetrazoles
Intermediate Tree Nodes
Not available
Direct Parent
Phenyltetrazoles and derivatives
Alternative Parents
P-methoxybenzoic acids and derivatives Benzoic acid esters Methoxyanilines Phenoxy compounds Methoxybenzenes Anisoles Benzoyl derivatives Alkyl aryl ethers Alkylarylthioethers Heteroaromatic compounds Carboxylic acid esters Sulfenyl compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
P-methoxybenzoic acid or derivatives - Phenyltetrazole - Benzoate ester - Methoxyaniline - Benzoic acid or derivatives - Phenol ether - Phenoxy compound - Benzoyl - Aryl thioether - Methoxybenzene - Anisole - Alkylarylthioether - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Carboxylic acid ester - Azacycle - Sulfenyl compound - Carboxylic acid derivative - Thioether - Ether - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenyltetrazoles and derivatives. These are compounds containing a phenyltetrazole skeleton, which consists of a tetrazole bound to a phenyl group.
External Descriptors
Not available