Compound Identification
SMILES
C[C@H](NC(=S)NC1=C(C)C=CC(C)=C1)[C@@H](N1CCOCC1)C1=CC=CS1
InChIKey
InChIKey=BYQUCLIJNMMBOX-QFBILLFUSA-N
Formula
C20H27N3OS2
Mass
389.58
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
p-Xylenes Aralkylamines Morpholines Thiophenes Heteroaromatic compounds Trialkylamines Thioureas Oxacyclic compounds Dialkyl ethers Azacyclic compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-phenylthiourea - P-xylene - Xylene - Aralkylamine - Morpholine - Oxazinane - Heteroaromatic compound - Thiophene - Tertiary amine - Thiourea - Tertiary aliphatic amine - Oxacycle - Ether - Dialkyl ether - Organoheterocyclic compound - Azacycle - Amine - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen 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