Compound Identification
SMILES
COC1=C(OC)C=C(C=C1)C(=O)NC(=S)NC1=CC=C(C=C1)C1=CC=C(CO)O1
InChIKey
InChIKey=IZWKLVDIALHVRN-UHFFFAOYSA-N
Formula
C21H20N2O5S
Mass
412.46
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
Dimethoxybenzenes Benzoic acids and derivatives Anisoles Phenoxy compounds Benzoyl derivatives Alkyl aryl ethers Furans Heteroaromatic compounds Thioureas Carboxylic acids and derivatives Oxacyclic compounds Primary alcohols Organonitrogen compounds Organopnictogen compounds Aromatic alcohols Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-acyl-phenylthiourea - O-dimethoxybenzene - Dimethoxybenzene - Benzoic acid or derivatives - Phenoxy compound - Anisole - Benzoyl - Methoxybenzene - Phenol ether - Alkyl aryl ether - Furan - Heteroaromatic compound - Thiourea - Carboxylic acid derivative - Ether - Oxacycle - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Alcohol - Organic oxide - Organopnictogen compound - Organosulfur compound - Primary alcohol - Aromatic alcohol - Aromatic heteromonocyclic 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