Compound Identification
SMILES
COC1=CC(\C=C\C(=O)NC2=NN=C(O2)C2=CC=C(Cl)S2)=CC(OC)=C1OC
InChIKey
InChIKey=DINIOZRYVQKXMB-QPJJXVBHSA-N
Formula
C18H16ClN3O5S
Mass
421.85
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Cinnamic acids and derivatives
- Subclass Cinnamic acid amides
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Class
Cinnamic acids and derivatives
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Cinnamic acids and derivatives
Subclass
Cinnamic acid amides
Intermediate Tree Nodes
Not available
Direct Parent
Cinnamic acid amides
Alternative Parents
Styrenes Phenoxy compounds N-arylamides Methoxybenzenes Anisoles 2,5-disubstituted thiophenes Alkyl aryl ethers Aryl chlorides 1,3,4-oxadiazoles Heteroaromatic compounds Secondary carboxylic acid amides Oxacyclic compounds Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Cinnamic acid amide - Phenoxy compound - Anisole - Phenol ether - Styrene - N-arylamide - Methoxybenzene - Alkyl aryl ether - 2,5-disubstituted thiophene - Aryl chloride - Aryl halide - Benzenoid - Monocyclic benzene moiety - Thiophene - Heteroaromatic compound - Azole - Oxadiazole - 1,3,4-oxadiazole - Secondary carboxylic acid amide - Carboxamide group - Oxacycle - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Organooxygen compound - Carbonyl group - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Hydrocarbon derivative - Organohalogen compound - Organochloride - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as cinnamic acid amides. These are amides of cinnamic acids. Cinnamic acid is an aromatic compound containing a benzene and a carboxylic acid group forming 3-phenylprop-2-enoic acid.
External Descriptors
Not available