Compound Identification
SMILES
COC1=CC=C(C=C1)N1C(=S)NC(=O)C(=CNCCCN2C=CN=C2)C1=O
InChIKey
InChIKey=MTPOMCDKWNDUJG-UHFFFAOYSA-N
Formula
C18H19N5O3S
Mass
385.44
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass N-phenylthioureas
-
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
Thiobarbituric acid derivatives Methoxyanilines Anisoles Phenoxy compounds Methoxybenzenes Alkyl aryl ethers Diazinanes N-substituted imidazoles Vinylogous amides Heteroaromatic compounds Thioureas Amino acids and derivatives Enamines Dialkylamines Azacyclic compounds Allylamines Organic oxides Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-phenylthiourea - Methoxyaniline - Thiobarbiturate - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - 1,3-diazinane - N-substituted imidazole - Azole - Heteroaromatic compound - Imidazole - Vinylogous amide - Amino acid or derivatives - Thiourea - Allylamine - Carboxylic acid derivative - Secondary aliphatic amine - Enamine - Ether - Azacycle - Organoheterocyclic compound - Secondary amine - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Organic nitrogen compound - Carbonyl group - Amine - Organonitrogen compound - Organooxygen compound - Organosulfur 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