Compound Identification
SMILES
S=C(NCCCN1CCOCC1)NC1=CC=CC(=C1)C1=NC2=CC=CC=C2S1
InChIKey
InChIKey=NLXSKLDRXCEYAS-UHFFFAOYSA-N
Formula
C21H24N4OS2
Mass
412.57
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
Benzothiazoles Morpholines Thiazoles Heteroaromatic compounds Trialkylamines Thioureas Oxacyclic compounds Dialkyl ethers Azacyclic compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-phenylthiourea - 1,3-benzothiazole - Morpholine - Oxazinane - Azole - Heteroaromatic compound - Thiazole - Tertiary amine - Tertiary aliphatic amine - Thiourea - Dialkyl ether - Ether - Oxacycle - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Amine - Aromatic heteropolycyclic 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