Compound Identification
SMILES
CCOC(=O)C(C#N)=C1SC(C(SC)=C(C=C(C#N)C#N)C2=CC=C(OC)C=C2)C(=O)N1C1=CC=C(Br)C=C1
InChIKey
InChIKey=YWMWEHFSRBSVOJ-UHFFFAOYSA-N
Formula
C28H21BrN4O4S2
Mass
621.52
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Phenol ethers
- Subclass Anisoles
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Class
Phenol ethers
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Phenol ethers
Subclass
Anisoles
Intermediate Tree Nodes
Not available
Direct Parent
Anisoles
Alternative Parents
Phenoxy compounds Methoxybenzenes Alkyl aryl ethers Bromobenzenes Vinylogous thioesters Aryl bromides Vinylogous amides Thiazolidines Tertiary carboxylic acid amides Enoate esters Thioenol ethers Ketene acetals Lactams Sulfenyl compounds Azacyclic compounds Nitriles Monocarboxylic acids and derivatives Carbonyl compounds Organobromides Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenoxy compound - Anisole - Methoxybenzene - Alkyl aryl ether - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Vinylogous thioester - Vinylogous amide - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Tertiary carboxylic acid amide - Thiazolidine - Thioenolether - Carboxylic acid ester - Carboxamide group - Ketene acetal or derivatives - Lactam - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Sulfenyl compound - Ether - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Organic oxide - Cyanide - Organic oxygen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Organohalogen compound - Organobromide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as anisoles. These are organic compounds containing a methoxybenzene or a derivative thereof.
External Descriptors
Not available