N-[1-[3,4-bis(fluoranyl)phenyl]ethyl]-3-methylsulfanyl-propan-1-amine

Systemtic Name: N-[1-[3,4-bis(fluoranyl)phenyl]ethyl]-3-methylsulfanyl-propan-1-amine Openeye Name: N-[1-(3,4-difluorophenyl)ethyl]-3-methylsulfanyl-propan-1-amine CAS Name: N-[1-(3,4-difluorophenyl)ethyl]-3-(methylthio)-1-propanamine IUPAC Name: N-[1-(3,4-difluorophenyl)ethyl]-3-methylsulfanylpropan-1-amine Traditional Name: 1-(3,4-difluorophenyl)ethyl-[3-(methylthio)propyl]amine Formula: C12H17F2NS MolecularWeight: 245.331886

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)F)F)NCCCSC

Isomeric SMILES

CC(C1=CC(=C(C=C1)F)F)NCCCSC

InChI

InChI=1S/C12H17F2NS/c1-9(15-6-3-7-16-2)10-4-5-11(13)12(14)8-10/h4-5,8-9,15H,3,6-7H2,1-2H3