2,2-bis(fluoranyl)-N-(thian-4-yl)-1,3-benzodioxol-5-amine

Systemtic Name: 2,2-bis(fluoranyl)-N-(thian-4-yl)-1,3-benzodioxol-5-amine Openeye Name: 2,2-difluoro-N-tetrahydrothiopyran-4-yl-1,3-benzodioxol-5-amine CAS Name: 2,2-difluoro-N-(4-thianyl)-1,3-benzodioxol-5-amine IUPAC Name: 2,2-difluoro-N-(thian-4-yl)-1,3-benzodioxol-5-amine Traditional Name: (2,2-difluoro-1,3-benzodioxol-5-yl)-tetrahydrothiopyran-4-yl-amine Formula: C12H13F2NO2S MolecularWeight: 273.298926

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCCC1NC2=CC3=C(C=C2)OC(O3)(F)F

Isomeric SMILES

C1CSCCC1NC2=CC3=C(C=C2)OC(O3)(F)F

InChI

InChI=1S/C12H13F2NO2S/c13-12(14)16-10-2-1-9(7-11(10)17-12)15-8-3-5-18-6-4-8/h1-2,7-8,15H,3-6H2