Compound Identification
SMILES
O=C(NC(=S)NC1=CC=CC(=C1)C1=NC2=C(O1)C=CC1=CC=CC=C21)C1=CC(OCC2=CC=CC=C2)=CC=C1
InChIKey
InChIKey=XEMOKXYVKDVSKM-UHFFFAOYSA-N
Formula
C32H23N3O3S
Mass
529.61
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
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Subclass
N-phenylthioureas
- Level 5 N-acyl-phenylthioureas
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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-acyl-phenylthioureas
Alternative Parents
Phenyl-1,3-oxazoles Naphthalenes Benzoic acids and derivatives Benzoxazoles Phenoxy compounds Benzoyl derivatives Phenol ethers Alkyl aryl ethers Heteroaromatic compounds Thioureas Carboxylic acids and derivatives Azacyclic compounds Oxacyclic compounds Organic oxides Hydrocarbon derivatives Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-acyl-phenylthiourea - Phenyl-1,3-oxazole - Naphthalene - Benzoic acid or derivatives - Benzoxazole - Phenoxy compound - Benzoyl - Phenol ether - Alkyl aryl ether - Azole - Heteroaromatic compound - Oxazole - Thiourea - Oxacycle - Ether - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Organic nitrogen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as n-acyl-phenylthioureas. These are thiourea derivatives where one nitrogen atom of the urea group is linked to a phenyl group and the other is acylated.
External Descriptors
Not available