7-[[3,4-bis(fluoranyl)phenyl]sulfanylmethyl]-2,3-dihydro-1,4-benzodioxin-6-amine

Systemtic Name: 7-[[3,4-bis(fluoranyl)phenyl]sulfanylmethyl]-2,3-dihydro-1,4-benzodioxin-6-amine Openeye Name: 7-[(3,4-difluorophenyl)sulfanylmethyl]-2,3-dihydro-1,4-benzodioxin-6-amine CAS Name: 7-[[(3,4-difluorophenyl)thio]methyl]-2,3-dihydro-1,4-benzodioxin-6-amine IUPAC Name: 7-[(3,4-difluorophenyl)sulfanylmethyl]-2,3-dihydro-1,4-benzodioxin-6-amine Traditional Name: [7-[[(3,4-difluorophenyl)thio]methyl]-2,3-dihydro-1,4-benzodioxin-6-yl]amine Formula: C15H13F2NO2S MolecularWeight: 309.331026

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C(=C2)N)CSC3=CC(=C(C=C3)F)F

Isomeric SMILES

C1COC2=C(O1)C=C(C(=C2)N)CSC3=CC(=C(C=C3)F)F

InChI

InChI=1S/C15H13F2NO2S/c16-11-2-1-10(6-12(11)17)21-8-9-5-14-15(7-13(9)18)20-4-3-19-14/h1-2,5-7H,3-4,8,18H2