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

Systemtic Name: N-[1-[3,4-bis(fluoranyl)phenyl]ethyl]thian-4-amine Openeye Name: N-[1-(3,4-difluorophenyl)ethyl]tetrahydrothiopyran-4-amine CAS Name: N-[1-(3,4-difluorophenyl)ethyl]-4-thianamine IUPAC Name: N-[1-(3,4-difluorophenyl)ethyl]thian-4-amine Traditional Name: 1-(3,4-difluorophenyl)ethyl-tetrahydrothiopyran-4-yl-amine Formula: C13H17F2NS MolecularWeight: 257.342586

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)F)F)NC2CCSCC2

Isomeric SMILES

CC(C1=CC(=C(C=C1)F)F)NC2CCSCC2

InChI

InChI=1S/C13H17F2NS/c1-9(16-11-4-6-17-7-5-11)10-2-3-12(14)13(15)8-10/h2-3,8-9,11,16H,4-7H2,1H3