EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:9620 - tolnaftate

Default Structure
ChEBI IDCHEBI:9620
ChEBI Nametolnaftate
Stars
DefinitionA monothiocarbamic ester that is the methyl(3-tolyl)carbamothioate ester of 2-naphthol. A synthetic anti-fungal agent used to treat jock itch, athlete's foot and ringworm.
Last Modified22 February 2017
DownloadsMolfile
FormulaC19H17NOS
Net Charge0
Average Mass307.418
Monoisotopic Mass307.10309
SMILESCc1cccc(N(C)C(=S)Oc2ccc3ccccc3c2)c1
InChIInChI=1S/C19H17NOS/c1-14-6-5-9-17(12-14)20(2)19(22)21-18-11-10-15-7-3-4-8-16(15)13-18/h3-13H,1-2H3
InChIKeyFUSNMLFNXJSCDI-UHFFFAOYSA-N
Wikipedia
Roles Classification
Biological Role:
antifungal drug  Any antifungal agent used to prevent or treat fungal infections in humans or animals.
Applications:
dermatologic drug  A drug used to treat or prevent skin disorders or for the routine care of skin.
antifungal drug  Any antifungal agent used to prevent or treat fungal infections in humans or animals.
antiinfective agent  A substance used in the prophylaxis or therapy of infectious diseases.
ChEBI Ontology
Outgoing Relation(s)
tolnaftate (CHEBI:9620) has functional parent 2-naphthol (CHEBI:10432)
tolnaftate (CHEBI:9620) has role antifungal drug (CHEBI:86327)
tolnaftate (CHEBI:9620) has role antiinfective agent (CHEBI:35441)
tolnaftate (CHEBI:9620) has role dermatologic drug (CHEBI:50177)
tolnaftate (CHEBI:9620) is a monothiocarbamic ester (CHEBI:38128)
IUPAC Name 
O-2-naphthyl methyl(3-methylphenyl)carbamothioate
INNs  Source
tolnaftateWHO MedNet
tolnaftateKEGG DRUG
tolnaftatoDrugBank
tolnaftatumDrugBank
Synonyms  Source
2-Naphthyl N-methyl-N-(3-tolyl)thionocarbamateChemIDplus
Methyl (3-methylphenyl)carbamothioic acid O-2-naphthalenyl esterNIST Chemistry WebBook
m,N-Dimethylthiocarbanilic acid O-2-naphthyl esterChemIDplus
N-methyl-N-(3-methylphenyl)-1-(naphthalen-2-yloxy)methanethioamideHMDB
NSC-233648ChEMBL
O-2-Naphthyl m,N-dimethylthiocarbanilateChemIDplus
Brand Names  Source
MycilChEMBL
SeparinKEGG DRUG
TimopedChEMBL
TinactinKEGG DRUG
TinadermChEMBL
Tinaderm plusChEMBL
Manual XrefsDatabases
3617DrugCentral
D00381KEGG DRUG
DB00525DrugBank
HMDB0005005HMDB
LSM-5554LINCS
TolnaftateWikipedia
US2010035939Patent
WO2010037089Patent
Registry NumbersSources
Reaxys:2752620Reaxys
CAS:2398-96-1ChemIDplus
CAS:2398-96-1NIST Chemistry WebBook
CAS:2398-96-1KEGG DRUG
Citations