Structure Information
Structure

Compound Identification

SMILES

N[C@@]1(C[C@@H](NC(=S)NC2=CC=CC=C2)C2[C@H](C12)C(O)=O)C(O)=O

InChIKey

InChIKey=CBAXDNTVGQGZNG-DNPOPVTFSA-N

Formula

C15H17N3O4S

Mass

335.38

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

N-phenylthioureas

Intermediate Tree Nodes

Not available

Direct Parent

N-phenylthioureas

Alternative Parents

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

Alpha-amino acid - Alpha-amino acid or derivatives - N-phenylthiourea - D-alpha-amino acid - L-alpha-amino acid - Cyclopropanecarboxylic acid - Cyclopropanecarboxylic acid or derivatives - Dicarboxylic acid or derivatives - Amino acid - Amino acid or derivatives - Thiourea - Carboxylic acid derivative - Carboxylic acid - Organic nitrogen compound - Primary aliphatic amine - Amine - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Primary amine - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic homopolycyclic 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

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