Compound Identification
SMILES
COC1=C(OC)C=C(C=CC(=O)NCC2=NN=C(SCC(=O)NC3=CC=C(Br)C=C3)N2CC=C)C=C1
InChIKey
InChIKey=RLGWCUXBCGINCO-UHFFFAOYSA-N
Formula
C25H26BrN5O4S
Mass
572.48
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
Dimethoxybenzenes Anilides Styrenes Phenoxy compounds Anisoles N-arylamides Alkyl aryl ethers Alkylarylthioethers Bromobenzenes Aryl bromides Triazoles Heteroaromatic compounds Secondary carboxylic acid amides Azacyclic compounds Sulfenyl compounds Hydrocarbon derivatives Organic oxides Organobromides Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Cinnamic acid amide - O-dimethoxybenzene - Dimethoxybenzene - Anilide - Phenol ether - Phenoxy compound - Aryl thioether - Anisole - Styrene - N-arylamide - Methoxybenzene - Alkyl aryl ether - Halobenzene - Bromobenzene - Alkylarylthioether - Aryl bromide - Benzenoid - Aryl halide - Monocyclic benzene moiety - Heteroaromatic compound - 1,2,4-triazole - Azole - Carboxamide group - Secondary carboxylic acid amide - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Carboxylic acid derivative - Ether - Thioether - Organosulfur compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organohalogen compound - Organobromide - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - 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