N-[1-(4-methylsulfanylphenyl)ethyl]heptan-1-amine

Systemtic Name: N-[1-(4-methylsulfanylphenyl)ethyl]heptan-1-amine Openeye Name: N-[1-(4-methylsulfanylphenyl)ethyl]heptan-1-amine CAS Name: N-[1-[4-(methylthio)phenyl]ethyl]-1-heptanamine IUPAC Name: N-[1-(4-methylsulfanylphenyl)ethyl]heptan-1-amine Traditional Name: heptyl-[1-[4-(methylthio)phenyl]ethyl]amine Formula: C16H27NS MolecularWeight: 265.45728

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNC(C)C1=CC=C(C=C1)SC

Isomeric SMILES

CCCCCCCNC(C)C1=CC=C(C=C1)SC

InChI

InChI=1S/C16H27NS/c1-4-5-6-7-8-13-17-14(2)15-9-11-16(18-3)12-10-15/h9-12,14,17H,4-8,13H2,1-3H3