Compound Identification
SMILES
COC(=O)C(=C/C1=CC(OC)=CC=C1)\C1=CC(=O)NC(=S)N1
InChIKey
InChIKey=MLUWKTURXFOTJS-XFFZJAGNSA-N
Formula
C15H14N2O4S
Mass
318.35
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Cinnamic acids and derivatives
-
Subclass
Hydroxycinnamic acids and derivatives
- Level 5 Coumaric acids and derivatives
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Subclass
Hydroxycinnamic acids and derivatives
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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
Hydroxycinnamic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Coumaric acids and derivatives
Alternative Parents
Cinnamic acid esters Phenoxy compounds Anisoles Methoxybenzenes 2-Thiopyrimidines Pyrimidones Pyrimidinethiones Alkyl aryl ethers Fatty acid esters Hydropyrimidines Vinylogous amides Methyl esters Enoate esters Heteroaromatic compounds Thioureas Lactams Monocarboxylic acids and derivatives Azacyclic compounds Carbonyl compounds Organic oxides Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Coumaric acid or derivatives - Cinnamic acid ester - Anisole - Phenoxy compound - Phenol ether - Methoxybenzene - Alkyl aryl ether - 2-thiopyrimidine - Fatty acid ester - Pyrimidinethione - Pyrimidone - Thiopyrimidine - Benzenoid - Hydropyrimidine - Fatty acyl - Monocyclic benzene moiety - Pyrimidine - Vinylogous amide - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Methyl ester - Heteroaromatic compound - Lactam - Carboxylic acid ester - Thiourea - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Ether - Azacycle - Hydrocarbon derivative - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxide - Organic oxygen compound - Carbonyl group - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as coumaric acids and derivatives. These are aromatic compounds containing Aromatic compounds containing a cinnamic acid moiety (or a derivative thereof) hydroxylated at the C2 (ortho-), C3 (meta-), or C4 (para-) carbon atom of the benzene ring.
External Descriptors
Not available