4-[3,4-bis(fluoranyl)phenyl]sulfanylbutan-1-amine

Systemtic Name: 4-[3,4-bis(fluoranyl)phenyl]sulfanylbutan-1-amine Openeye Name: 4-(3,4-difluorophenyl)sulfanylbutan-1-amine CAS Name: 4-[(3,4-difluorophenyl)thio]-1-butanamine IUPAC Name: 4-(3,4-difluorophenyl)sulfanylbutan-1-amine Traditional Name: 4-[(3,4-difluorophenyl)thio]butylamine Formula: C10H13F2NS MolecularWeight: 217.278726

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1SCCCCN)F)F

Isomeric SMILES

C1=CC(=C(C=C1SCCCCN)F)F

InChI

InChI=1S/C10H13F2NS/c11-9-4-3-8(7-10(9)12)14-6-2-1-5-13/h3-4,7H,1-2,5-6,13H2