Compound Identification
SMILES
COC(=O)C1=C(C)NC(C)=C(C1C1=CC(NC(=S)NCCCN2CCC(CC2)C2CCCCC2)=CC=C1)C(=O)OC
InChIKey
InChIKey=JCPKCSBCKAOVTO-UHFFFAOYSA-N
Formula
C32H46N4O4S
Mass
582.8
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass N-phenylthioureas
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
N-phenylthioureas
Intermediate Tree Nodes
Not available
Direct Parent
N-phenylthioureas
Alternative Parents
Dihydropyridinecarboxylic acids and derivatives Piperidines Dicarboxylic acids and derivatives Vinylogous amides Methyl esters Enoate esters Trialkylamines Thioureas Amino acids and derivatives Enamines Dialkylamines Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-phenylthiourea - Dihydropyridinecarboxylic acid derivative - Dihydropyridine - Dicarboxylic acid or derivatives - Hydropyridine - Piperidine - Methyl ester - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Vinylogous amide - Tertiary aliphatic amine - Thiourea - Tertiary amine - Amino acid or derivatives - Carboxylic acid ester - Secondary amine - Carboxylic acid derivative - Organoheterocyclic compound - Secondary aliphatic amine - Enamine - Azacycle - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as n-phenylthioureas. These are compounds containing a N-phenylthiourea moiety, which is structurally characterized by a phenyl group linked to one nitrogen atom of a thiourea group.
External Descriptors
Not available