2-azanyl-6-(2-methylphenoxy)hexane-1-thiol

Systemtic Name: 2-azanyl-6-(2-methylphenoxy)hexane-1-thiol Openeye Name: 2-amino-6-(2-methylphenoxy)hexane-1-thiol CAS Name: 2-amino-6-(2-methylphenoxy)-1-hexanethiol IUPAC Name: 2-amino-6-(2-methylphenoxy)hexane-1-thiol Traditional Name: 2-amino-6-(2-methylphenoxy)hexane-1-thiol Formula: C13H21NOS MolecularWeight: 239.37694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCCCCC(CS)N

Isomeric SMILES

CC1=CC=CC=C1OCCCCC(CS)N

InChI

InChI=1S/C13H21NOS/c1-11-6-2-3-8-13(11)15-9-5-4-7-12(14)10-16/h2-3,6,8,12,16H,4-5,7,9-10,14H2,1H3