Compound Identification
SMILES
CCNC(=S)NN=CC1=CC=CC=C1OC(=O)C1=C(Cl)C2=CC=CC=C2S1
InChIKey
InChIKey=MSVJMFIJVADNHD-UHFFFAOYSA-N
Formula
C19H16ClN3O2S2
Mass
417.93
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
- Class Phenol esters
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Phenol esters
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Phenol esters
Alternative Parents
1-benzothiophenes Thiophene carboxylic acids and derivatives Phenoxy compounds Thiosemicarbazones Aryl chlorides Vinylogous halides Heteroaromatic compounds Carboxylic acid esters Organosulfur compounds Organooxygen compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenol ester - 1-benzothiophene - Benzothiophene - Phenoxy compound - Thiophene carboxylic acid or derivatives - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Thiosemicarbazone - Heteroaromatic compound - Thiophene - Vinylogous halide - Carboxylic acid ester - Carboxylic acid derivative - Organoheterocyclic compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenol esters. These are aromatic compounds containing a benzene ring substituted by a hydroxyl group and an ester group.
External Descriptors
Not available