2-azanyl-6-[3-(trifluoromethyl)phenoxy]hexane-1-thiol hydrochloride

Systemtic Name: 2-azanyl-6-[3-(trifluoromethyl)phenoxy]hexane-1-thiol hydrochloride Openeye Name: 2-amino-6-[3-(trifluoromethyl)phenoxy]hexane-1-thiol hydrochloride CAS Name: 2-amino-6-[3-(trifluoromethyl)phenoxy]-1-hexanethiol hydrochloride IUPAC Name: 2-amino-6-[3-(trifluoromethyl)phenoxy]hexane-1-thiol hydrochloride Traditional Name: 2-amino-6-[3-(trifluoromethyl)phenoxy]hexane-1-thiol hydrochloride Formula: C13H19ClF3NOS MolecularWeight: 329.80927

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCCCCC(CS)N)C(F)(F)F.Cl

Isomeric SMILES

C1=CC(=CC(=C1)OCCCCC(CS)N)C(F)(F)F.Cl

InChI

InChI=1S/C13H18F3NOS.ClH/c14-13(15,16)10-4-3-6-12(8-10)18-7-2-1-5-11(17)9-19;/h3-4,6,8,11,19H,1-2,5,7,9,17H2;1H