Compound Identification
SMILES
COC1=C(OCC2=CC(Cl)=CC=C2)C=CC(C[NH2+]CC2=CC=CS2)=C1
InChIKey
InChIKey=YXZPUNVUPNERPS-UHFFFAOYSA-O
Formula
C20H21ClNO2S
Mass
374.9
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Phenylmethylamines
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenylmethylamines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylmethylamines
Alternative Parents
Phenoxy compounds Methoxybenzenes Benzylamines Anisoles Chlorobenzenes Aralkylamines Alkyl aryl ethers Aryl chlorides Thiophenes Quaternary ammonium salts Heteroaromatic compounds Dialkylamines Organochlorides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Anisole - Phenoxy compound - Benzylamine - Phenol ether - Phenylmethylamine - Methoxybenzene - Alkyl aryl ether - Chlorobenzene - Halobenzene - Aralkylamine - Aryl chloride - Aryl halide - Quaternary ammonium salt - Heteroaromatic compound - Thiophene - Organoheterocyclic compound - Secondary aliphatic amine - Ether - Amine - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organohalogen compound - Organochloride - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylmethylamines. These are compounds containing a phenylmethtylamine moiety, which consists of a phenyl group substituted by an methanamine.
External Descriptors
Not available