Compound Identification
SMILES
O[C@@H]1[C@@H](O)[C@@H](CC2=CC=CC=C2)N(CCCCCNC(=S)NC2=CC=CC=C2)C(=O)N(CCCCCNC(=S)NC2=CC=CC=C2)[C@@H]1CC1=CC=CC=C1
InChIKey
InChIKey=ATXKYIYRLJEGQW-WESAGZJESA-N
Formula
C43H54N6O3S2
Mass
767.06
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
1,3-diazepanes Ureas Thioureas Secondary alcohols 1,2-diols Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-phenylthiourea - 1,3-diazepane - Diazepane - 1,2-diol - Urea - Thiourea - Secondary alcohol - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Carbonyl group - Alcohol - Organic oxygen 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