Compound Identification
SMILES
O=C(CSC1=NC2=CC=CC=C2O1)N1CC[NH+](CC2=CC=CC=C2)CC1
InChIKey
InChIKey=HXINZUAIZUKVFP-UHFFFAOYSA-O
Formula
C20H22N3O2S
Mass
368.47
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzoxazoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzoxazoles
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzoxazoles
Alternative Parents
Benzylamines Phenylmethylamines Alkylarylthioethers Aralkylamines N-alkylpiperazines Tertiary carboxylic acid amides Heteroaromatic compounds Oxazoles Trialkylamines Amino acids and derivatives Sulfenyl compounds Azacyclic compounds Oxacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organopnictogen compounds Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoxazole - Phenylmethylamine - Benzylamine - Aryl thioether - Aralkylamine - Alkylarylthioether - N-alkylpiperazine - 1,4-diazinane - Benzenoid - Monocyclic benzene moiety - Piperazine - Tertiary carboxylic acid amide - Heteroaromatic compound - Oxazole - Azole - Amino acid or derivatives - Carboxamide group - Tertiary amine - Tertiary aliphatic amine - Oxacycle - Carboxylic acid derivative - Azacycle - Sulfenyl compound - Thioether - Organonitrogen compound - Organic nitrogen compound - Amine - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Organopnictogen compound - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzoxazoles. These are organic compounds containing a benzene fused to an oxazole ring Oxazole is five-membered aromatic ring with a nitrogen and an oxygen atoms at the 1- and 3-position, respectively.
External Descriptors
Not available